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Details

Stereochemistry ABSOLUTE
Molecular Formula C47H76O18
Molecular Weight 929.0955
Optical Activity UNSPECIFIED
Defined Stereocenters 25 / 25
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BACOPASIDE II

SMILES

[H][C@@]9(O[C@@H]1[C@@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](CO)O[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=WZWPYJOPCULCLQ-UOXCDNDQSA-N
InChI=1S/C47H76O18/c1-21(2)14-22-18-58-47-19-46(20-59-47)23(38(47)45(22,7)57)8-9-28-43(5)12-11-29(42(3,4)27(43)10-13-44(28,46)6)63-41-37(65-39-34(55)31(52)25(16-49)61-39)36(32(53)26(17-50)62-41)64-40-35(56)33(54)30(51)24(15-48)60-40/h14,22-41,48-57H,8-13,15-20H2,1-7H3/t22-,23-,24-,25+,26-,27+,28-,29+,30-,31+,32-,33+,34-,35-,36+,37-,38+,39+,40+,41+,43+,44-,45+,46+,47-/m1/s1

HIDE SMILES / InChI

Molecular Formula C47H76O18
Molecular Weight 929.0955
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 24 / 25
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Triterpene saponins from Bacopa monnieri and their antidepressant effects in two mice models.
2007 Apr
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:00:19 GMT 2023
Edited
by admin
on Sat Dec 16 08:00:19 GMT 2023
Record UNII
ZO6L404Y9T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BACOPASIDE II
Common Name English
BACOPASIDE II (CONSTITUENT OF BACOPA) [DSC]
Common Name English
BACOPASIDE II, (-)-
Common Name English
Classification Tree Code System Code
DSLD 2558 (Number of products:6)
Created by admin on Sat Dec 16 08:00:19 GMT 2023 , Edited by admin on Sat Dec 16 08:00:19 GMT 2023
Code System Code Type Description
FDA UNII
ZO6L404Y9T
Created by admin on Sat Dec 16 08:00:19 GMT 2023 , Edited by admin on Sat Dec 16 08:00:19 GMT 2023
PRIMARY
PUBCHEM
9876264
Created by admin on Sat Dec 16 08:00:19 GMT 2023 , Edited by admin on Sat Dec 16 08:00:19 GMT 2023
PRIMARY
CAS
382146-66-9
Created by admin on Sat Dec 16 08:00:19 GMT 2023 , Edited by admin on Sat Dec 16 08:00:19 GMT 2023
PRIMARY