TANGHINIGENIN ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H34O6
Molecular Weight	430.5339
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)O[C@H]1CC[C@@]2(C)[C@H](C[C@@H]3O[C@]34[C@@H]2CC[C@]5(C)[C@H](CC[C@]45O)C6=CC(=O)OC6)C1

InChI

InChIKey=IKIOUWIUYNOLSV-FKFPRKCISA-N

InChI=1S/C25H34O6/c1-14(26)30-17-4-7-22(2)16(11-17)12-20-25(31-20)19(22)6-8-23(3)18(5-9-24(23,25)28)15-10-21(27)29-13-15/h10,16-20,28H,4-9,11-13H2,1-3H3/t16-,17-,18+,19+,20-,22-,23+,24+,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H34O6
Molecular Weight	430.5339
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 `Mon Mar 31 22:58:06 GMT 2025` Edited by `admin` on `Mon Mar 31 22:58:06 GMT 2025`
Record UNII	WJV4U1O78C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TANGHINIGENIN ACETATE

Common Name

English

ACETYLTANGHINIGENIN

Preferred Name

English

TANGHINIGENIN ACETATE [MI]

Common Name

English

CARD-20(22)-ENOLIDE, 3-(ACETYLOXY)-7,8-EPOXY-14-HYDROXY-, (3.BETA.,5.BETA.,7.BETA.)-

Systematic Name

English

TANGHINIGENIN, 3-ACETATE

Common Name

English

Code System Code Type Description

MERCK INDEX

m490

Created by admin on Mon Mar 31 22:58:06 GMT 2025 , Edited by admin on Mon Mar 31 22:58:06 GMT 2025

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Merck Index

FDA UNII

WJV4U1O78C

Created by admin on Mon Mar 31 22:58:06 GMT 2025 , Edited by admin on Mon Mar 31 22:58:06 GMT 2025

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PUBCHEM

91617977

Created by admin on Mon Mar 31 22:58:06 GMT 2025 , Edited by admin on Mon Mar 31 22:58:06 GMT 2025

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CAS

4642-56-2

Created by admin on Mon Mar 31 22:58:06 GMT 2025 , Edited by admin on Mon Mar 31 22:58:06 GMT 2025

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