U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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

Approval Year

PubMed

PubMed

TitleDatePubMed
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