URALSAPONIN U

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H62O17
Molecular Weight	838.9315
Optical Activity	( + )
Defined Stereocenters	20 / 20
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

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(=O)C=C5[C@]6([H])C[C@@](C)(CC[C@]6(C)CC[C@@]45C)C(O)=O)[C@@]2(C)CO)C(O)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]7O)C(O)=O

InChI

InChIKey=WBQVRPYEEYUEBQ-ZZRFBVNQSA-N

InChI=1S/C42H62O17/c1-37-11-12-38(2,36(54)55)16-19(37)18-15-20(44)31-39(3)9-8-22(40(4,17-43)21(39)7-10-42(31,6)41(18,5)14-13-37)56-35-30(26(48)25(47)29(58-35)33(52)53)59-34-27(49)23(45)24(46)28(57-34)32(50)51/h15,19,21-31,34-35,43,45-49H,7-14,16-17H2,1-6H3,(H,50,51)(H,52,53)(H,54,55)/t19-,21+,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35+,37+,38+,39-,40+,41+,42+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

URALSAPONIN U

Common Name

English

3.BETA.-O-(.BETA.-DGLUCURONOPYRANOSYL-(1->2)-.BETA.-D-GLUCURONOPYRANOSYL)-24-HYDROXY-11-OXO-OLEAN-12-EN-29-OIC ACID

Common Name

English

24-HYDROXY-20.ALPHA.-GLYCYRRHIZIN

Common Name

English

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, (3.BETA.,4.BETA.,20.ALPHA.)-20-CARBOXY-23-HYDROXY-11-OXO-30-NOROLEAN-12-EN-3-YL 2-O-.BETA.-D-GLUCOPYRANURONOSYL-

Systematic Name

English

Code System Code Type Description

FDA UNII

HT2MUA8H8Z

Created by admin on Sat Dec 16 01:38:37 GMT 2023 , Edited by admin on Sat Dec 16 01:38:37 GMT 2023

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CAS

1616062-86-2

Created by admin on Sat Dec 16 01:38:37 GMT 2023 , Edited by admin on Sat Dec 16 01:38:37 GMT 2023

PRIMARY

PUBCHEM

162368379

Created by admin on Sat Dec 16 01:38:37 GMT 2023 , Edited by admin on Sat Dec 16 01:38:37 GMT 2023

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SUBSTANCE RECORD


					HT2MUA8H8Z

URALSAPONIN U