GYMNEMIC ACID IX

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C47H72O18
Molecular Weight	925.0638
Optical Activity	UNSPECIFIED
Defined Stereocenters	21 / 21
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C\C=C(/C)C(=O)O[C@H]1[C@H](O)[C@]2(CO)[C@@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)C7=O)[C@H]6O)C(O)=O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2CC1(C)C

InChI

InChIKey=CZFCLAXAWADCPY-RSUBFJOJSA-N

InChI=1S/C47H72O18/c1-9-21(2)39(60)65-37-36(57)47(20-50)23(16-42(37,3)4)22-10-11-26-43(5)14-13-28(44(6,19-49)25(43)12-15-45(26,7)46(22,8)17-27(47)51)62-41-33(56)34(32(55)35(64-41)38(58)59)63-40-31(54)30(53)29(52)24(18-48)61-40/h9-10,23-30,32-37,40-41,48-53,55-57H,11-20H2,1-8H3,(H,58,59)/b21-9+/t23-,24+,25+,26+,27-,28-,29+,30-,32-,33+,34-,35-,36-,37-,40-,41+,43-,44-,45+,46+,47-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C47H72O18
Molecular Weight	925.0638
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	21 / 21
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:08:18 GMT 2025` Edited by `admin` on `Mon Mar 31 21:08:18 GMT 2025`
Record UNII	4QWR1P5B0N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GYMNEMIC ACID IX

Common Name

English

GYMNEMIC ACID IX (CONSTITUENT OF GYMNEMA) [DSC]

Preferred Name

English

GYMNEMIC ACID IX, (+)-

Common Name

English

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, (3.BETA.,4.ALPHA.,16.BETA.,21.BETA.(E),22.ALPHA.)-16,22,23,28-TETRAHYDROXY-21-((2-METHYL-1-OXO-2-BUTENYL)OXY)OLEAN-12-EN-3-YL 3-O-.BETA.-D-ARABINO-HEXOPYRANOS-2-ULOS-1-YL-

Systematic Name

English

Code System Code Type Description

FDA UNII

4QWR1P5B0N

Created by admin on Mon Mar 31 21:08:18 GMT 2025 , Edited by admin on Mon Mar 31 21:08:18 GMT 2025

PRIMARY

CAS

131653-20-8

Created by admin on Mon Mar 31 21:08:18 GMT 2025 , Edited by admin on Mon Mar 31 21:08:18 GMT 2025

PRIMARY

PUBCHEM

91617808

Created by admin on Mon Mar 31 21:08:18 GMT 2025 , Edited by admin on Mon Mar 31 21:08:18 GMT 2025

PRIMARY