SOYASAPOGENOL D

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H52O3
Molecular Weight	472.7428
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@]3(C)[C@]([H])(CCC4=C5CC(C)(C)C[C@@H](OC)[C@]5(C)CC[C@@]34C)[C@@]1(C)CC[C@H](O)[C@]2(C)CO

InChI

InChIKey=JAQZKPHHLRTVCY-ZHRKTGFNSA-N

InChI=1S/C31H52O3/c1-26(2)17-21-20-9-10-23-28(4)13-12-24(33)29(5,19-32)22(28)11-14-31(23,7)30(20,6)16-15-27(21,3)25(18-26)34-8/h22-25,32-33H,9-19H2,1-8H3/t22-,23-,24+,25-,27-,28+,29-,30-,31-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C31H52O3
Molecular Weight	472.7428
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:32:55 UTC 2023` Edited by `admin` on `Sat Dec 16 05:32:55 UTC 2023`
Record UNII	22HBQ1HBAP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SOYASAPOGENOL D

Common Name

English

OLEAN-13(18)-ENE-3,23-DIOL, 22-METHOXY-, (3.BETA.,4.BETA.,22.BETA.)-

Common Name

English

Code System Code Type Description

CAS

65892-76-4

Created by admin on Sat Dec 16 05:32:56 UTC 2023 , Edited by admin on Sat Dec 16 05:32:56 UTC 2023

PRIMARY

PUBCHEM

46173903

Created by admin on Sat Dec 16 05:32:56 UTC 2023 , Edited by admin on Sat Dec 16 05:32:56 UTC 2023

PRIMARY

EPA CompTox

DTXSID90984365

Created by admin on Sat Dec 16 05:32:56 UTC 2023 , Edited by admin on Sat Dec 16 05:32:56 UTC 2023

PRIMARY

FDA UNII

22HBQ1HBAP

Created by admin on Sat Dec 16 05:32:56 UTC 2023 , Edited by admin on Sat Dec 16 05:32:56 UTC 2023

PRIMARY

Related Record Type Details


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