DIOSGENIN ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H44O4
Molecular Weight	456.6573
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@]3([H])[C@]4([H])CC=C5C[C@H](CC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])[C@H](C)[C@@]6(CC[C@@H](C)CO6)O2)OC(C)=O

InChI

InChIKey=CZCROZIJKBXZDP-IKEOEMBBSA-N

InChI=1S/C29H44O4/c1-17-8-13-29(31-16-17)18(2)26-25(33-29)15-24-22-7-6-20-14-21(32-19(3)30)9-11-27(20,4)23(22)10-12-28(24,26)5/h6,17-18,21-26H,7-16H2,1-5H3/t17-,18+,21+,22-,23+,24+,25+,26+,27+,28+,29-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H44O4
Molecular Weight	456.6573
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: http://www.sciencedirect.com/science/article/pii/0003986157905416

Diosgenin acetate is a naturally occuring steroidal sapogenin.

Approval Year

Conditions

Condition	Modality	Targets	Highest Phase	Product
Unknown 2578

PubMed

Title	Date	PubMed
Microbial transformations of diosgenin by the white-rot basidiomycete Coriolus versicolor.	2011 Oct 28	21985022

Sample Use Guides

In Vivo Use Guide

In a preclinical study, rats were fed diet with 1% of diosgenin acetate.

Route of Administration: Oral

In Vitro Use Guide

In a cytotoxicity bioassay, U87 cells were seeded onto 96-well microtiter plates at a density of 1000/well and treated with diosgenin acetate (100 uM) for 48 h, following which 10 uL of XTT was added. The plates were incubated for another 4 h at 37 Celsius degrees.

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:29:00 GMT 2023` Edited by `admin` on `Fri Dec 15 19:29:00 GMT 2023`
Record UNII	PEK7912LLC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIOSGENIN ACETATE

Common Name

English

NSC-15490

Code

English

SPIROST-5-EN-3-OL, ACETATE, (3.BETA.,25R)-

Common Name

English

Code System Code Type Description

FDA UNII

PEK7912LLC