GRAYANOSIDE-B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H42O9
Molecular Weight	498.6063
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@]1(O)C[C@]23C[C@H]1CC[C@H]2C(=C)[C@@H]4C[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C(C)(C)[C@@]4(O)[C@H](O)C3

InChI

InChIKey=ANXMAYKAWZAHMB-CMCDTBIBSA-N

InChI=1S/C26H42O9/c1-12-14-6-5-13-8-25(14,11-24(13,4)32)9-17(28)26(33)15(12)7-18(23(26,2)3)35-22-21(31)20(30)19(29)16(10-27)34-22/h13-22,27-33H,1,5-11H2,2-4H3/t13-,14+,15+,16-,17-,18+,19-,20+,21-,22+,24-,25-,26+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

GRAYANOSIDE-B

Common Name

English

GRAYANOSIDE B

Preferred Name

English

.BETA.-D-GLUCOPYRANOSIDE, (3.BETA.,6.BETA.)-5,6,16-TRIHYDROXYGRAYANOTOX-10(20)-EN-3-YL

Systematic Name

English

(2R,3S,4S,5R,6R)-2-(HYDROXYMETHYL)-6-(((1R,3R,4R,6S,8S,10R,13R,14R)-3,4,14-TRIHYDROXY-5,5,14-TRIMETHYL-9-METHYLIDENETETRACYCLO(11.2.1.0^(1,10).0^(4,8))HEXADECAN-6-YL)OXY)OXANE-3,4,5-TRIOL

Systematic Name

English

(3.BETA.,6.BETA.)-5,6,16-TRIHYDROXYGRAYANOTOX-10(20)-EN-3-YL .BETA.-D-GLUCOPYRANOSIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

101316949

Created by admin on Tue Apr 01 20:47:00 GMT 2025 , Edited by admin on Tue Apr 01 20:47:00 GMT 2025

PRIMARY

FDA UNII

5H6FZG4L2D

Created by admin on Tue Apr 01 20:47:00 GMT 2025 , Edited by admin on Tue Apr 01 20:47:00 GMT 2025

PRIMARY

CAS

70474-75-8

Created by admin on Tue Apr 01 20:47:00 GMT 2025 , Edited by admin on Tue Apr 01 20:47:00 GMT 2025

PRIMARY

SUBSTANCE RECORD


					5H6FZG4L2D

GRAYANOSIDE-B