18-Hydroxy-all-trans-retinoic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H28O3
Molecular Weight	316.4345
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	4
Charge	0

SHOW SMILES / InChI

Structure of 18-Hydroxy-all-trans-retinoic acid

Structure Search

SMILES

CC(\C=C\C1=C(CO)CCCC1(C)C)=C/C=C/C(C)=C/C(O)=O

InChI

InChIKey=XSJOIRFEYHJNAW-FCKHSPHMSA-N

InChI=1S/C20H28O3/c1-15(7-5-8-16(2)13-19(22)23)10-11-18-17(14-21)9-6-12-20(18,3)4/h5,7-8,10-11,13,21H,6,9,12,14H2,1-4H3,(H,22,23)/b8-5+,11-10+,15-7+,16-13+

HIDE SMILES / InChI

Molecular Formula	C20H28O3
Molecular Weight	316.4345
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	4
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:38:24 GMT 2025` Edited by `admin` on `Wed Apr 02 11:38:24 GMT 2025`
Record UNII	REU22CK3HJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

18-Hydroxy-all-trans-retinoic acid

Common Name

English

18-Hydroxyretinoic acid

Preferred Name

English

Retinoic acid, 18-hydroxy-

Common Name

English

Ro-12-4825

Common Name

English

(2E,4E,6E,8E)-9-[2-(hydroxymethyl)-6,6-dimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoic acid

Systematic Name

English

2,4,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-(6,6-dimethyl-2-(hydroxymethyl)-1-cyclohexen-1-yl)-, (E)-

Systematic Name

English

all-trans-18-Hydroxy Retinoic Acid

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID501313930

Created by admin on Wed Apr 02 11:38:24 GMT 2025 , Edited by admin on Wed Apr 02 11:38:24 GMT 2025

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FDA UNII

REU22CK3HJ

Created by admin on Wed Apr 02 11:38:24 GMT 2025 , Edited by admin on Wed Apr 02 11:38:24 GMT 2025

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PUBCHEM

6506224

Created by admin on Wed Apr 02 11:38:24 GMT 2025 , Edited by admin on Wed Apr 02 11:38:24 GMT 2025

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CAS

63531-93-1

Created by admin on Wed Apr 02 11:38:24 GMT 2025 , Edited by admin on Wed Apr 02 11:38:24 GMT 2025

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