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Details

Stereochemistry ABSOLUTE
Molecular Formula C42H62O15
Molecular Weight 806.9327
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of URALSAPONIN V

SMILES

[H][C@@]7(O[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@@]1([H])O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])C=CC5=C6C[C@@](C)(CC[C@]6(C)CC[C@@]45C)C(O)=O)C2(C)C)C(O)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]7O)C(O)=O

InChI

InChIKey=WPDHECQXVOACTR-RSNVNIAASA-N
InChI=1S/C42H62O15/c1-37(2)21-10-13-42(7)22(9-8-19-20-18-39(4,36(52)53)15-14-38(20,3)16-17-41(19,42)6)40(21,5)12-11-23(37)54-35-31(27(46)26(45)30(56-35)33(50)51)57-34-28(47)24(43)25(44)29(55-34)32(48)49/h8-9,21-31,34-35,43-47H,10-18H2,1-7H3,(H,48,49)(H,50,51)(H,52,53)/t21-,22+,23-,24-,25-,26-,27-,28+,29-,30-,31+,34-,35+,38+,39+,40-,41+,42+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
URALSAPONIN V
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, (3.BETA.,20.ALPHA.)-20-CARBOXY-30-NOROLEANA-11,13(18)-DIEN-3-YL 2-O-.BETA.-D-GLUCOPYRANURONOSYL-
Systematic Name English
3.BETA.-O-(.BETA.-D-GLUCURONOPYRANOSYL-(1->2)-.BETA.-DGLUCURONOPYRANOSYL)OLEAN-11,13(18)-DIEN-29-OIC ACID
Common Name English
Code System Code Type Description
FDA UNII
0HDJ1A004S
Created by admin on Sat Dec 16 08:18:50 GMT 2023 , Edited by admin on Sat Dec 16 08:18:50 GMT 2023
PRIMARY
PUBCHEM
86278364
Created by admin on Sat Dec 16 08:18:50 GMT 2023 , Edited by admin on Sat Dec 16 08:18:50 GMT 2023
PRIMARY
CAS
1616062-87-3
Created by admin on Sat Dec 16 08:18:50 GMT 2023 , Edited by admin on Sat Dec 16 08:18:50 GMT 2023
PRIMARY