Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C37H58O10 |
Molecular Weight | 662.8518 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 16 / 16 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@]([H])(C[C@]([H])([C@@]1([H])C(C)(C)O1)OC(=O)C)[C@@]2([H])C(=O)[C@@]([H])([C@@]3(C)[C@]4([H])CC[C@@]5([H])C(C)(C)[C@]([H])(CC[C@]65C[C@@]46CC[C@]23C)O[C@@]7([H])[C@@]([H])([C@]([H])([C@]([H])(CO7)O)O)O)O
InChI
InChIKey=IHEJMZHKJYHVFF-NETQQFODSA-N
InChI=1S/C37H58O10/c1-18(15-21(45-19(2)38)30-33(5,6)47-30)25-27(41)29(43)35(8)23-10-9-22-32(3,4)24(46-31-28(42)26(40)20(39)16-44-31)11-12-36(22)17-37(23,36)14-13-34(25,35)7/h18,20-26,28-31,39-40,42-43H,9-17H2,1-8H3/t18-,20+,21-,22+,23+,24+,25+,26+,28-,29+,30+,31+,34-,35-,36-,37+/m1/s1
Molecular Formula | C37H58O10 |
Molecular Weight | 662.8518 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 16 / 16 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Originator
Sources: http://pubs.acs.org/doi/abs/10.1021/np0200818
Curator's Comment:: Collaborative Research in the Pharmaceutical Sciences (PCRPS, M/C 877), and UIC/ NIH Center for Botanical Dietary Supplements Research,
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Jun 26 11:12:17 UTC 2021
by
admin
on
Sat Jun 26 11:12:17 UTC 2021
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Record UNII |
408998370C
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Record Status |
Validated (UNII)
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Record Version |
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408998370C
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10865257
Created by
admin on Sat Jun 26 11:12:17 UTC 2021 , Edited by admin on Sat Jun 26 11:12:17 UTC 2021
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Related Record | Type | Details | ||
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PARENT -> CONSTITUENT ALWAYS PRESENT | |||
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CONSTITUENT ALWAYS PRESENT -> PARENT |