26-HYDROXY RH2

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H62O9
Molecular Weight	638.8721
Optical Activity	UNSPECIFIED
Defined Stereocenters	15 / 15
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

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@]5([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C(C)(C)[C@]4([H])CC[C@@]23C)[C@@](C)(O)CC\C=C(/C)CO

InChI

InChIKey=UTTXMCFEQIEWFA-QPBBTJJSSA-N

InChI=1S/C36H62O9/c1-20(18-37)9-8-13-36(7,43)21-10-15-35(6)27(21)22(39)17-25-33(4)14-12-26(32(2,3)24(33)11-16-34(25,35)5)45-31-30(42)29(41)28(40)23(19-38)44-31/h9,21-31,37-43H,8,10-19H2,1-7H3/b20-9+/t21-,22+,23+,24-,25+,26-,27-,28+,29-,30+,31-,33-,34+,35+,36-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C36H62O9
Molecular Weight	638.8721
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	15 / 15
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:46:57 UTC 2023` Edited by `admin` on `Sat Dec 16 16:46:57 UTC 2023`
Record UNII	UJ91K7JL3L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

26-HYDROXY RH2

Common Name

English

.BETA.-D-GLUCOPYRANOSIDE, (3.BETA.,12.BETA.,24E)-12,20,26-TRIHYDROXYDAMMAR-24-EN-3-YL

Systematic Name

English

20(S)-GINSENOSIDE RH2 METABOLITE M1-1

Common Name

English

Code System Code Type Description

PUBCHEM

118753486

Created by admin on Sat Dec 16 16:46:57 UTC 2023 , Edited by admin on Sat Dec 16 16:46:57 UTC 2023

PRIMARY

FDA UNII

UJ91K7JL3L

Created by admin on Sat Dec 16 16:46:57 UTC 2023 , Edited by admin on Sat Dec 16 16:46:57 UTC 2023

PRIMARY

CAS

1698870-39-1

Created by admin on Sat Dec 16 16:46:57 UTC 2023 , Edited by admin on Sat Dec 16 16:46:57 UTC 2023

PRIMARY

Related Record Type Details


					0JU44A5KWG

20(S)-GINSENOSIDE RH2

PARENT -> METABOLITE

Comments:

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