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Details

Stereochemistry RACEMIC
Molecular Formula C20H28O3
Molecular Weight 316.4345
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of RO-23-4293

SMILES

COC1=C(C)C(C)=C(\C=C\C(C)=C\CCC(C)C(O)=O)C(C)=C1

InChI

InChIKey=XWONXGHYIROBKV-OGFJCPFKSA-N
InChI=1S/C20H28O3/c1-13(8-7-9-14(2)20(21)22)10-11-18-15(3)12-19(23-6)17(5)16(18)4/h8,10-12,14H,7,9H2,1-6H3,(H,21,22)/b11-10+,13-8+

HIDE SMILES / InChI

Molecular Formula C20H28O3
Molecular Weight 316.4345
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 2
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:06:22 GMT 2023
Edited
by admin
on Sat Dec 16 17:06:22 GMT 2023
Record UNII
VGO8H11ZJ8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RO-23-4293
Code English
ACITRETIN METABOLITE I
Common Name English
RO 23-4293
Code English
(5E,7E)-8-(4-METHOXY-2,3,6-TRIMETHYLPHENYL)-2,6-DIMETHYL-5,7-OCTADIENOIC ACID
Systematic Name English
5,7-OCTADIENOIC ACID, 8-(4-METHOXY-2,3,6-TRIMETHYLPHENYL)-2,6-DIMETHYL-, (5E,7E)-
Systematic Name English
Code System Code Type Description
CAS
121693-28-5
Created by admin on Sat Dec 16 17:06:22 GMT 2023 , Edited by admin on Sat Dec 16 17:06:22 GMT 2023
PRIMARY
PUBCHEM
10064368
Created by admin on Sat Dec 16 17:06:22 GMT 2023 , Edited by admin on Sat Dec 16 17:06:22 GMT 2023
PRIMARY
FDA UNII
VGO8H11ZJ8
Created by admin on Sat Dec 16 17:06:22 GMT 2023 , Edited by admin on Sat Dec 16 17:06:22 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE