GYMNEMIC ACID IV

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C41H64O13
Molecular Weight	764.9391
Optical Activity	UNSPECIFIED
Defined Stereocenters	17 / 17
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]6(O[C@H]1CC[C@@]2(C)[C@@]([H])(CC[C@]3(C)[C@]2([H])CC=C4[C@]5([H])CC(C)(C)[C@@H](OC(=O)C(\C)=C\C)[C@H](O)[C@]5(CO)[C@@H](O)C[C@@]34C)[C@]1(C)CO)O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(O)=O

InChI

InChIKey=UOZWTEQSPIEUHT-LHNBZPRDSA-N

InChI=1S/C41H64O13/c1-9-20(2)34(51)54-32-31(48)41(19-43)22(16-36(32,3)4)21-10-11-24-37(5)14-13-26(52-35-29(47)27(45)28(46)30(53-35)33(49)50)38(6,18-42)23(37)12-15-39(24,7)40(21,8)17-25(41)44/h9-10,22-32,35,42-48H,11-19H2,1-8H3,(H,49,50)/b20-9+/t22-,23+,24+,25-,26-,27-,28-,29+,30-,31-,32-,35+,37-,38-,39+,40+,41-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C41H64O13
Molecular Weight	764.9391
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	17 / 17
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:12:19 GMT 2023` Edited by `admin` on `Sat Dec 16 09:12:19 GMT 2023`
Record UNII	53ZB8903Z1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GYMNEMIC ACID IV

Common Name

English

GYMNEMIC ACID IV (CONSTITUENT OF GYMNEMA) [DSC]

Common Name

English

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

Systematic Name

English

Classification Tree Code System Code

DSLD

2860 (Number of products:2)

Created by admin on Sat Dec 16 09:12:19 GMT 2023 , Edited by admin on Sat Dec 16 09:12:19 GMT 2023

Code System Code Type Description

CAS

121903-96-6

Created by admin on Sat Dec 16 09:12:19 GMT 2023 , Edited by admin on Sat Dec 16 09:12:19 GMT 2023

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PUBCHEM

14264063

Created by admin on Sat Dec 16 09:12:19 GMT 2023 , Edited by admin on Sat Dec 16 09:12:19 GMT 2023

PRIMARY

FDA UNII

53ZB8903Z1

Created by admin on Sat Dec 16 09:12:19 GMT 2023 , Edited by admin on Sat Dec 16 09:12:19 GMT 2023

PRIMARY