URALSAPONIN O

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H60O16
Molecular Weight	820.9162
Optical Activity	UNSPECIFIED
Defined Stereocenters	20 / 20
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]8(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@]7(C)C[C@@H](OC7=O)[C@]6(C)CC[C@@]45C)C2(C)C)C(O)=O)O[C@@H]([C@H](O)[C@H](O)[C@H]8O)C(O)=O

InChI

InChIKey=ACCYCJOHUMRMMV-HUWKTHDESA-N

InChI=1S/C42H60O16/c1-37(2)20-8-11-42(7)31(19(43)14-17-18-15-38(3)16-22(55-36(38)53)39(18,4)12-13-41(17,42)6)40(20,5)10-9-21(37)54-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50/h14,18,20-31,34-35,44-48H,8-13,15-16H2,1-7H3,(H,49,50)(H,51,52)/t18-,20-,21-,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 O

Common Name

English

3.BETA.-O-(.BETA.-D-GALACTURONOPYRANOSYL-(1->2)-.BETA.-DGLUCURONOPYRANOSYL)GLABROLIDE

Common Name

English

(3.BETA.,20.BETA.,22.BETA.)-22,29-EPOXY-11,29-DIOXOOLEAN-12-EN-3-YL 2-O-.BETA.-D-GALACTOPYRANURONOSYL-.BETA.-D-GLUCOPYRANOSIDURONIC ACID

Systematic Name

English

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, (3.BETA.,20.BETA.,22.BETA.)-22,29-EPOXY-11,29-DIOXOOLEAN-12-EN-3-YL 2-O-.BETA.-D-GALACTOPYRANURONOSYL-

Systematic Name

English

Code System Code Type Description

CAS

1616062-80-6

Created by admin on Sat Dec 16 01:54:51 GMT 2023 , Edited by admin on Sat Dec 16 01:54:51 GMT 2023

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PUBCHEM

163184198

Created by admin on Sat Dec 16 01:54:51 GMT 2023 , Edited by admin on Sat Dec 16 01:54:51 GMT 2023

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FDA UNII

5AB6MJY2RS

Created by admin on Sat Dec 16 01:54:51 GMT 2023 , Edited by admin on Sat Dec 16 01:54:51 GMT 2023

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SUBSTANCE RECORD


					5AB6MJY2RS

URALSAPONIN O