MassBank Record: MSBNK-RIKEN_NPDepo-NGA00676
ACCESSION: MSBNK-RIKEN_NPDepo-NGA00676
RECORD_TITLE: Foetoside C; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+Na]+
DATE: 2018.04.04
AUTHORS: Nogawa T, Okano A, CSRS, RIKEN
LICENSE: CC BY
COMMENT: Origin: Plant
COMMENT: SubCategory_DNP: Triterpenoids
CH$NAME: Foetoside C
CH$COMPOUND_CLASS: Terpenoids
CH$FORMULA: C58H94O25
CH$EXACT_MASS: 1191.3809
CH$SMILES: CC1OC(OC2C(OC3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)OC6OC(COC7OC(CO)C(O)C(O)C7O)C(O)C(O)C6O)CC[C@]45C)C3(C)C)OCC(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O
CH$IUPAC: InChI=1S/C58H94O25/c1-24-34(62)45(81-48-41(69)35(63)27(60)21-74-48)44(72)50(77-24)82-46-36(64)28(61)22-75-51(46)80-33-12-13-55(6)31(54(33,4)5)11-14-57(8)32(55)10-9-25-26-19-53(2,3)15-17-58(26,18-16-56(25,57)7)52(73)83-49-43(71)40(68)38(66)30(79-49)23-76-47-42(70)39(67)37(65)29(20-59)78-47/h9,24,26-51,59-72H,10-23H2,1-8H3/t24?,26?,27?,28?,29?,30?,31?,32?,33?,34?,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?,47?,48?,49?,50?,51?,55-,56+,57+,58?/m0/s1
CH$LINK: CAS
94483-11-1
CH$LINK: INCHIKEY
BGKLFKHHSFCDKC-KPHKKTKMSA-N
CH$LINK: PUBCHEM
CID:44661022
AC$INSTRUMENT: Agilent 6410 Triple Quadrupole LC/MS system
AC$INSTRUMENT_TYPE: LC-ESI-QQQ
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: PRECURSOR_TYPE [M+Na]+
PK$SPLASH: splash10-03di-3589333344-aca7132ceb296eab153d
PK$NUM_PEAK: 4822
PK$PEAK: m/z int. rel.int.
60.1 3.37 3
60.2 4.36 4
60.3 5.86 5
60.4 7.14 7
60.5 7.33 7
60.6 6.3 6
60.7 4.68 4
61.1 3.52 3
61.2 5.3 5
61.3 7.19 7
61.4 8.29 8
61.5 8.1 8
61.6 6.85 6
67.2 3.71 3
67.3 5.37 5
67.4 7.3 7
67.5 8.4 8
67.6 8.24 8
67.7 7.36 7
67.8 6.53 6
67.9 6.08 6
68.0 5.8 5
68.1 5.42 5
68.2 4.97 4
68.3 4.67 4
68.4 4.57 4
68.5 4.61 4
68.6 4.82 4
68.7 5.12 5
68.8 5.2 5
68.9 4.82 4
69.0 4.15 4
69.1 3.72 3
69.2 3.83 3
69.3 4.48 4
69.4 5.32 5
69.5 6.0 5
69.6 6.28 6
69.7 6.29 6
69.8 6.33 6
69.9 6.4 6
70.0 6.11 6
70.9 3.57 3
71.0 4.7 4
71.1 6.07 6
71.2 6.95 6
71.3 6.9 6
71.4 6.14 6
82.1 3.7 3
82.2 4.88 4
82.3 6.0 5
82.4 6.69 6
82.5 7.0 6
82.6 7.12 7
82.7 6.97 6
82.8 6.27 6
82.9 4.9 4
85.5 3.96 3
85.6 5.14 5
85.7 6.48 6
85.8 7.33 7
85.9 6.9 6
86.0 5.02 5
86.1 2.49 2
86.4 1.19 1
86.5 2.65 2
86.6 4.1 4
86.7 5.42 5
86.8 6.58 6
86.9 7.33 7
87.0 7.55 7
87.1 7.25 7
87.2 6.54 6
87.3 5.52 5
88.2 3.42 3
88.3 4.46 4
88.4 5.46 5
88.5 6.41 6
88.6 7.08 7
88.7 6.95 6
88.8 5.85 5
88.9 4.17 4
89.3 2.85 2
89.4 4.0 3
89.5 4.79 4
89.6 5.36 5
89.7 6.07 6
89.8 6.67 6
89.9 6.41 6
90.0 5.09 5
91.3 4.26 4
91.4 5.63 5
91.5 7.0 6
91.6 7.71 7
91.7 7.61 7
91.8 6.94 6
91.9 6.15 6
92.0 5.52 5
92.1 5.19 5
92.2 5.19 5
92.3 5.35 5
92.4 5.41 5
92.5 5.41 5
92.6 5.47 5
92.7 5.46 5
92.8 5.0 4
92.9 4.02 4
96.1 4.34 4
96.2 5.42 5
96.3 6.32 6
96.4 6.53 6
96.5 6.18 6
96.6 5.83 5
96.7 5.66 5
96.8 5.41 5
96.9 4.92 4
97.0 4.55 4
97.1 4.7 4
97.2 5.29 5
97.3 5.79 5
97.4 5.97 5
97.5 6.15 6
97.6 6.53 6
97.7 6.72 6
97.8 6.27 6
103.0 5.39 5
103.1 6.88 6
103.2 8.05 8
103.3 7.91 7
105.7 5.08 5
105.8 5.86 5
105.9 7.13 7
106.0 8.33 8
106.1 8.66 8
106.2 7.95 7
106.3 6.86 6
106.4 6.3 6
106.5 6.53 6
106.6 7.1 7
106.7 7.37 7
106.8 7.0 6
106.9 6.22 6
107.0 5.61 5
107.1 5.59 5
107.2 6.05 6
107.3 6.48 6
107.4 6.44 6
107.5 5.94 5
107.6 5.33 5
107.7 4.92 4
107.8 4.91 4
107.9 5.1 5
108.0 5.23 5
108.1 5.17 5
108.2 5.13 5
108.3 5.25 5
108.4 5.54 5
108.5 5.9 5
108.6 6.17 6
108.7 6.11 6
108.8 5.76 5
108.9 5.53 5
109.0 5.85 5
109.1 6.66 6
109.2 7.52 7
109.3 7.84 7
109.4 7.16 7
109.5 5.73 5
109.8 4.72 4
109.9 5.83 5
110.0 7.04 7
110.1 7.72 7
110.2 7.54 7
110.3 6.82 6
110.4 6.18 6
110.5 5.86 5
110.6 5.77 5
110.7 5.91 5
110.8 6.18 6
110.9 6.26 6
111.0 6.17 6
111.1 6.35 6
111.2 6.86 6
111.3 7.05 7
111.4 6.22 6
121.6 5.0 4
121.7 6.73 6
121.8 8.68 8
121.9 10.08 10
122.0 10.35 10
122.1 9.27 9
122.2 7.39 7
125.1 4.82 4
125.2 6.17 6
125.3 7.5 7
125.4 8.19 8
125.5 7.98 7
125.6 7.08 7
126.3 5.26 5
126.4 6.29 6
126.5 7.69 7
126.6 8.91 8
126.7 9.21 9
126.8 8.38 8
135.5 4.92 4
135.6 6.48 6
135.7 7.89 7
135.8 8.33 8
135.9 7.7 7
136.0 6.76 6
136.1 6.34 6
136.2 6.62 6
136.3 7.12 7
136.4 7.33 7
136.5 7.21 7
136.6 7.12 7
136.7 7.34 7
136.8 7.72 7
136.9 7.68 7
137.0 6.77 6
142.6 4.2 4
142.7 5.57 5
142.8 7.12 7
142.9 8.05 8
143.0 8.13 8
143.1 7.64 7
143.2 7.02 7
143.3 6.41 6
143.4 5.72 5
143.8 3.87 3
143.9 5.11 5
144.0 6.45 6
144.1 7.36 7
144.2 7.75 7
144.3 7.69 7
144.4 7.3 7
144.5 6.61 6
144.6 5.89 5
144.7 5.42 5
144.8 5.26 5
144.9 5.44 5
145.0 6.31 6
145.1 7.95 7
145.2 9.62 9
145.3 10.25 10
145.4 9.51 9
145.5 8.08 8
147.2 5.7 5
147.3 8.18 8
147.4 9.71 9
147.5 9.58 9
147.6 8.46 8
150.7 4.96 4
150.8 6.26 6
150.9 7.76 7
151.0 8.67 8
151.1 8.58 8
151.2 7.73 7
151.3 6.72 6
151.4 5.78 5
151.8 4.39 4
151.9 5.7 5
152.0 6.99 6
152.1 7.57 7
152.2 7.19 7
152.3 6.25 6
152.4 5.53 5
152.5 5.53 5
152.6 6.12 6
152.7 6.81 6
152.8 7.09 7
152.9 6.71 6
153.0 5.92 5
153.1 5.41 5
153.2 5.54 5
153.3 5.89 5
153.4 5.76 5
153.5 5.04 5
154.6 3.74 3
154.7 4.98 4
154.8 6.36 6
154.9 6.93 6
155.0 6.62 6
155.1 6.21 6
155.2 6.27 6
155.3 6.68 6
155.4 6.97 6
155.5 6.88 6
155.6 6.47 6
155.7 5.87 5
155.8 5.06 5
156.3 3.84 3
156.4 5.43 5
156.5 6.9 6
156.6 7.7 7
156.7 7.7 7
156.8 7.24 7
156.9 6.82 6
157.0 6.74 6
157.1 6.88 6
157.2 6.77 6
158.4 4.07 4
158.5 5.57 5
158.6 6.73 6
158.7 6.96 6
158.8 6.37 6
158.9 5.43 5
160.6 5.1 5
160.7 6.36 6
160.8 7.49 7
160.9 7.67 7
161.0 6.76 6
168.2 3.82 3
168.3 5.39 5
168.4 6.74 6
168.5 7.43 7
168.6 7.13 7
168.7 6.07 6
174.5 4.68 4
174.6 5.72 5
174.7 6.66 6
174.8 6.84 6
174.9 6.06 6
182.1 4.42 4
182.2 5.44 5
182.3 6.35 6
182.4 6.66 6
182.5 6.27 6
182.6 5.52 5
182.7 4.78 4
182.8 3.97 3
183.1 2.41 2
183.2 3.97 3
183.3 6.18 6
183.4 7.78 7
183.5 7.99 7
183.6 7.0 6
183.7 5.54 5
186.6 7.24 7
186.7 8.21 8
186.8 9.25 9
186.9 10.03 10
187.0 10.29 10
187.1 10.12 10
187.2 9.74 9
187.3 9.13 9
187.4 8.02 8
187.5 6.32 6
187.6 4.45 4
189.2 4.87 4
189.3 5.82 5
189.4 6.53 6
189.5 6.9 6
189.6 7.07 7
189.7 7.01 7
189.8 6.28 6
189.9 4.62 4
196.0 3.56 3
196.1 4.84 4
196.2 5.8 5
196.3 6.16 6
196.4 6.1 6
196.5 5.91 5
196.6 5.83 5
196.7 5.94 5
196.8 6.19 6
196.9 6.24 6
197.0 5.87 5
197.1 5.3 5
197.2 4.99 4
197.3 4.94 4
197.4 4.67 4
197.5 3.87 3
197.6 3.02 3
197.7 2.93 2
197.8 3.74 3
197.9 4.68 4
198.0 4.81 4
198.1 3.95 3
198.5 3.36 3
198.6 4.81 4
198.7 6.16 6
198.8 6.93 6
198.9 6.66 6
199.0 5.25 5
199.4 3.3 3
199.5 4.16 4
199.6 4.9 4
199.7 5.44 5
199.8 5.55 5
199.9 5.14 5
200.0 4.47 4
200.1 4.15 4
200.2 4.39 4
200.3 4.72 4
200.4 4.55 4
200.5 4.04 4
200.6 4.08 4
200.7 5.04 5
200.8 6.15 6
200.9 6.45 6
201.0 5.81 5
201.1 4.99 4
201.2 4.83 4
201.3 5.51 5
201.4 6.46 6
201.5 6.88 6
201.6 6.63 6
201.7 6.2 6
201.8 6.04 6
201.9 6.11 6
202.0 6.13 6
202.1 5.92 5
202.2 5.47 5
202.3 4.99 4
202.4 4.71 4
202.5 4.67 4
202.6 4.68 4
202.7 4.68 4
202.8 4.82 4
202.9 5.14 5
203.0 5.46 5
203.1 5.59 5
203.2 5.5 5
203.3 5.43 5
203.4 5.73 5
203.5 6.5 6
203.6 7.39 7
203.7 7.92 7
203.8 7.83 7
203.9 7.11 7
204.0 5.99 5
204.4 5.4 5
204.5 6.53 6
204.6 7.43 7
204.7 7.6 7
204.8 6.9 6
204.9 5.62 5
205.7 5.58 5
205.8 6.83 6
205.9 7.95 7
206.0 8.09 8
206.1 6.91 6
206.2 5.02 5
206.6 4.7 4
206.7 5.5 5
206.8 6.39 6
206.9 7.27 7
207.0 7.97 7
207.1 8.26 8
207.2 7.96 7
207.3 7.06 7
208.8 2.3 2
208.9 3.69 3
209.0 4.72 4
209.1 5.14 5
209.2 5.41 5
209.3 5.96 5
209.4 6.6 6
209.5 6.69 6
209.6 6.03 6
211.4 5.17 5
211.5 6.2 6
211.6 6.94 6
211.7 7.37 7
211.8 7.48 7
211.9 7.13 7
212.0 6.22 6
213.5 3.54 3
213.6 5.06 5
213.7 6.27 6
213.8 7.06 7
213.9 7.56 7
214.0 7.42 7
214.1 6.24 6
214.2 4.42 4
214.5 3.18 3
214.6 4.31 4
214.7 5.72 5
214.8 6.83 6
214.9 6.96 6
215.3 4.82 4
215.4 6.16 6
215.5 7.08 7
215.6 7.02 7
215.7 6.36 6
215.8 5.9 5
215.9 5.96 5
216.0 6.31 6
216.1 6.52 6
216.2 6.5 6
216.3 6.42 6
216.4 6.48 6
216.5 6.7 6
216.6 6.79 6
216.7 6.55 6
216.8 6.24 6
216.9 6.39 6
217.0 7.02 7
217.1 7.48 7
217.2 7.16 7
217.3 6.09 6
219.1 2.18 2
219.2 3.32 3
219.3 4.9 4
219.4 6.26 6
219.5 6.66 6
219.6 5.91 5
230.0 4.2 4
230.1 5.02 5
230.2 5.9 5
230.3 6.57 6
230.4 6.75 6
230.5 6.41 6
230.6 5.88 5
230.7 5.58 5
230.8 5.55 5
230.9 5.58 5
231.0 5.69 5
231.1 6.03 6
231.2 6.55 6
231.3 7.06 7
231.4 7.4 7
231.5 7.49 7
231.6 7.18 7
231.7 6.49 6
231.8 5.69 5
231.9 5.11 5
232.0 4.86 4
232.1 4.83 4
232.2 4.88 4
232.3 4.91 4
232.4 5.01 5
232.5 5.36 5
232.6 5.86 5
232.7 6.23 6
232.8 6.16 6
232.9 5.61 5
233.0 4.89 4
233.1 4.4 4
233.2 4.48 4
233.3 5.05 5
233.4 5.66 5
233.5 5.92 5
233.6 5.89 5
233.7 5.92 5
233.8 6.13 6
233.9 6.12 6
234.0 5.44 5
234.1 4.16 4
234.5 3.94 3
234.6 5.34 5
234.7 6.53 6
234.8 7.17 7
234.9 7.22 7
235.0 6.8 6
235.1 6.11 6
235.2 5.52 5
235.3 5.43 5
235.4 5.89 5
235.5 6.53 6
235.6 6.97 6
235.7 7.08 7
235.8 6.87 6
235.9 6.33 6
236.0 5.67 5
236.1 5.29 5
236.2 5.57 5
236.3 6.46 6
236.4 7.48 7
236.5 8.09 8
236.6 8.01 8
236.7 7.4 7
236.8 6.61 6
236.9 6.13 6
237.0 6.17 6
237.1 6.57 6
237.2 6.88 6
237.3 6.99 6
237.4 7.04 7
237.5 7.09 7
237.6 7.02 7
237.7 6.76 6
237.8 6.26 6
237.9 5.58 5
238.0 4.98 4
238.1 4.84 4
238.2 5.17 5
238.3 5.5 5
238.4 5.41 5
238.5 5.1 5
238.6 5.11 5
238.7 5.65 5
238.8 6.28 6
238.9 6.43 6
239.0 5.91 5
239.1 5.04 5
239.2 4.32 4
239.3 4.05 4
239.4 4.26 4
239.5 4.71 4
239.6 5.12 5
239.7 5.45 5
239.8 5.78 5
239.9 6.09 6
240.0 6.13 6
240.1 5.95 5
240.2 5.9 5
240.3 6.16 6
240.4 6.37 6
240.5 6.09 6
240.6 5.58 5
240.7 5.45 5
240.8 5.92 5
240.9 6.66 6
241.0 7.29 7
241.1 7.61 7
241.2 7.36 7
241.3 6.43 6
241.6 4.55 4
241.7 5.87 5
241.8 7.62 7
241.9 8.73 8
242.0 8.51 8
242.1 7.15 7
242.2 5.45 5
242.5 4.11 4
242.6 5.27 5
242.7 6.54 6
242.8 7.39 7
242.9 7.66 7
243.0 7.72 7
243.1 7.89 7
243.2 8.04 8
243.3 7.7 7
247.4 6.15 6
247.5 7.03 7
247.6 7.76 7
247.7 8.11 8
247.8 7.81 7
247.9 6.78 6
248.0 5.34 5
248.3 4.4 4
248.4 6.21 6
248.5 7.96 7
248.6 8.45 8
248.7 7.54 7
248.8 6.2 6
252.8 4.91 4
252.9 6.37 6
253.0 7.59 7
253.1 7.77 7
253.2 7.09 7
253.3 6.39 6
253.4 6.02 6
253.5 5.57 5
263.7 5.02 5
263.8 6.24 6
263.9 7.53 7
264.0 8.22 8
264.1 8.01 8
264.2 6.96 6
264.3 5.43 5
266.9 4.86 4
267.0 5.64 5
267.1 6.39 6
267.2 7.11 7
267.3 7.68 7
267.4 7.76 7
267.5 7.13 7
267.6 6.03 6
271.5 4.18 4
271.6 5.37 5
271.7 6.86 6
271.8 7.77 7
271.9 7.57 7
273.7 3.05 3
273.8 4.2 4
273.9 5.47 5
274.0 6.42 6
274.1 6.67 6
274.2 6.23 6
274.3 5.58 5
274.4 5.22 5
274.5 5.04 5
274.6 4.58 4
274.7 3.75 3
274.8 3.07 3
274.9 3.12 3
275.0 4.03 4
275.1 5.45 5
275.2 6.89 6
275.3 7.69 7
275.4 7.4 7
275.5 6.28 6
275.6 5.16 5
276.1 3.14 3
276.2 4.43 4
276.3 6.05 6
276.4 7.23 7
276.5 7.71 7
276.6 7.78 7
276.7 7.55 7
276.8 7.0 6
276.9 6.26 6
277.0 5.63 5
277.1 5.32 5
277.2 5.46 5
277.3 6.09 6
277.4 6.93 6
277.5 7.26 7
277.6 6.64 6
279.9 4.48 4
280.0 5.56 5
280.1 6.63 6
280.2 7.31 7
280.3 7.43 7
280.4 6.79 6
280.8 5.22 5
280.9 6.78 6
281.0 8.04 8
281.1 8.43 8
281.2 7.88 7
281.3 6.86 6
281.4 5.82 5
285.9 3.1 3
286.0 4.58 4
286.1 6.53 6
286.2 8.05 8
286.3 8.29 8
286.4 7.35 7
286.5 6.28 6
286.6 5.98 5
286.7 6.29 6
286.8 6.49 6
286.9 6.5 6
287.0 6.67 6
287.1 7.04 7
287.2 7.26 7
287.3 7.19 7
287.4 6.9 6
287.5 6.53 6
287.6 6.04 6
287.7 5.55 5
287.8 5.27 5
287.9 5.39 5
288.0 5.81 5
288.1 6.16 6
288.2 6.21 6
288.3 6.13 6
288.4 5.98 5
288.5 5.61 5
288.6 4.9 4
288.7 4.23 4
288.8 4.15 4
288.9 4.66 4
289.0 5.18 5
289.1 5.28 5
289.2 5.2 5
289.3 5.4 5
289.4 5.86 5
289.5 6.16 6
289.6 6.02 6
289.7 5.41 5
290.1 3.86 3
290.2 5.01 5
290.3 6.08 6
290.4 6.53 6
290.5 6.43 6
290.6 5.97 5
290.7 5.23 5
291.4 3.6 3
291.5 5.1 5
291.6 6.72 6
291.7 8.24 8
291.8 9.24 9
291.9 9.15 9
292.0 7.98 7
292.1 6.27 6
292.5 4.49 4
292.6 5.75 5
292.7 6.78 6
292.8 6.96 6
292.9 6.2 6
293.0 5.0 4
293.5 3.98 3
293.6 5.36 5
293.7 6.52 6
293.8 6.78 6
293.9 6.06 6
295.9 3.76 3
296.0 5.14 5
296.1 6.49 6
296.2 7.38 7
296.3 7.63 7
296.4 7.08 7
298.4 3.82 3
298.5 4.43 4
298.6 5.23 5
298.7 6.16 6
298.8 6.77 6
298.9 6.75 6
299.0 6.19 6
299.1 5.45 5
299.2 4.9 4
299.3 4.85 4
299.4 5.37 5
299.5 6.23 6
299.6 7.01 7
299.7 7.34 7
299.8 6.93 6
299.9 5.72 5
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//
