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Details

Stereochemistry ABSOLUTE
Molecular Formula C46H74O20S
Molecular Weight 979.133
Optical Activity UNSPECIFIED
Defined Stereocenters 24 / 24
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BACOPASIDE I

SMILES

[H][C@@]9(O[C@@H]1[C@@H](O[C@]2([H])O[C@H](COS(O)(=O)=O)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)CO[C@@]1([H])O[C@H]3CC[C@@]4(C)[C@@]([H])(CC[C@]5(C)[C@]4([H])CC[C@]6([H])[C@]7([H])[C@]8(C[C@@]56CO8)OC[C@@H](C=C(C)C)[C@]7(C)O)C3(C)C)O[C@@H](CO)[C@H](O)[C@H]9O

InChI

InChIKey=SKFWOYHZBNAJGA-YAOMZRCFSA-N
InChI=1S/C46H74O20S/c1-21(2)14-22-16-59-46-19-45(20-60-46)23(37(46)44(22,7)54)8-9-28-42(5)12-11-29(41(3,4)27(42)10-13-43(28,45)6)64-40-36(66-38-33(52)30(49)25(15-47)62-38)35(24(48)17-58-40)65-39-34(53)32(51)31(50)26(63-39)18-61-67(55,56)57/h14,22-40,47-54H,8-13,15-20H2,1-7H3,(H,55,56,57)/t22-,23-,24+,25+,26-,27+,28-,29+,30+,31-,32+,33-,34-,35+,36-,37+,38+,39+,40+,42+,43-,44+,45+,46-/m1/s1

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Triterpene saponins from Bacopa monnieri and their antidepressant effects in two mice models.
2007 Apr
Name Type Language
BACOPASIDE I
Common Name English
BACOPASIDE I, (-)-
Common Name English
BACOPASIDE I (CONSTITUENT OF BACOPA) [DSC]
Common Name English
Code System Code Type Description
PUBCHEM
21599442
Created by admin on Sat Dec 16 08:04:23 GMT 2023 , Edited by admin on Sat Dec 16 08:04:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID00746870
Created by admin on Sat Dec 16 08:04:23 GMT 2023 , Edited by admin on Sat Dec 16 08:04:23 GMT 2023
PRIMARY
CAS
382148-47-2
Created by admin on Sat Dec 16 08:04:23 GMT 2023 , Edited by admin on Sat Dec 16 08:04:23 GMT 2023
PRIMARY
FDA UNII
36B8WUA361
Created by admin on Sat Dec 16 08:04:23 GMT 2023 , Edited by admin on Sat Dec 16 08:04:23 GMT 2023
PRIMARY