20,24-EPOXYDAMMARANE-3BETA,12BETA-DIOL-25-O-GLUCORONIDE, (20S,24S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H60O10
Molecular Weight	652.8556
Optical Activity	UNSPECIFIED
Defined Stereocenters	16 / 16
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 20,24-EPOXYDAMMARANE-3BETA,12BETA-DIOL-25-O-GLUCORONIDE, (20S,24S)-

Structure Search

SMILES

[H][C@@]1(CC[C@]2(C)[C@]1([H])[C@H](O)C[C@]3([H])[C@@]4(C)CC[C@H](O)C(C)(C)[C@]4([H])CC[C@@]23C)[C@]5(C)CC[C@H](O5)C(C)(C)O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(O)=O

InChI

InChIKey=IXJGZEZCKFQBLU-JFZKSKDQSA-N

InChI=1S/C36H60O10/c1-31(2)20-10-15-34(6)21(33(20,5)13-11-22(31)38)17-19(37)24-18(9-14-35(24,34)7)36(8)16-12-23(45-36)32(3,4)46-30-27(41)25(39)26(40)28(44-30)29(42)43/h18-28,30,37-41H,9-17H2,1-8H3,(H,42,43)/t18-,19+,20-,21+,22-,23-,24-,25-,26-,27+,28-,30-,33-,34+,35+,36-/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

20,24-EPOXYDAMMARANE-3BETA,12BETA-DIOL-25-O-GLUCORONIDE, (20S,24S)-

Common Name

English

(2S,3S,4S,5R,6S)-6-(1-((2S,5S)-5-((3S,5R,8R,9R,10R,12R,13R,14R,17S)-3,12-DIHYDROXY-4,4,8,10,14-PENTAMETHYL-2,3,5,6,7,9,11,12,13,15,16,17-DODECAHYDRO-1H-CYCLOPENTA(A)PHENANTHREN-17-YL)-5-METHYL-TETRAHYDROFURAN-2-YL)-1-METHYL-ETHOXY)-3,4,5-TRIHYDROXY-TETRA

Systematic Name

English

(20S)-PROTOPANAXADIOL METABOLITE M7-1

Common Name

English

Code System Code Type Description

PUBCHEM

118753223

Created by admin on Sat Dec 16 17:31:12 GMT 2023 , Edited by admin on Sat Dec 16 17:31:12 GMT 2023

PRIMARY

FDA UNII

6T3RCB5AXS