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Details

Stereochemistry RACEMIC
Molecular Formula C20H28O3
Molecular Weight 316.4345
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 4
Charge 0

SHOW SMILES / InChI
Structure of 5,6-EPOXYTRETINOIN

SMILES

CC(\C=C\[C@@]12O[C@]1(C)CCCC2(C)C)=C/C=C/C(C)=C/C(O)=O

InChI

InChIKey=KEEHJLBAOLGBJZ-ILKMQKNNSA-N
InChI=1S/C20H28O3/c1-15(8-6-9-16(2)14-17(21)22)10-13-20-18(3,4)11-7-12-19(20,5)23-20/h6,8-10,13-14H,7,11-12H2,1-5H3,(H,21,22)/b9-6+,13-10+,15-8+,16-14+/t19-,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H28O3
Molecular Weight 316.4345
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 4
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:37:16 UTC 2023
Edited
by admin
on Sat Dec 16 08:37:16 UTC 2023
Record UNII
R1UDJ9769D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5,6-EPOXYTRETINOIN
Common Name English
RETINOIC ACID, 5,6-EPOXY-5,6-DIHYDRO-
Systematic Name English
ALL-TRANS-5,6-EPOXYRETINOIC ACID
Common Name English
TRETINOIN IMPURITY G [EP IMPURITY]
Common Name English
5,6-EPOXY-5,6-DIHYDRORETINOIC ACID
Common Name English
5,6-EPOXY-ATRA
Common Name English
5,6-EPOXYRETINOIC ACID
Common Name English
Code System Code Type Description
FDA UNII
R1UDJ9769D
Created by admin on Sat Dec 16 08:37:16 UTC 2023 , Edited by admin on Sat Dec 16 08:37:16 UTC 2023
PRIMARY
CAS
13100-69-1
Created by admin on Sat Dec 16 08:37:16 UTC 2023 , Edited by admin on Sat Dec 16 08:37:16 UTC 2023
PRIMARY
EPA CompTox
DTXSID70927033
Created by admin on Sat Dec 16 08:37:16 UTC 2023 , Edited by admin on Sat Dec 16 08:37:16 UTC 2023
PRIMARY
PUBCHEM
92854578
Created by admin on Sat Dec 16 08:37:16 UTC 2023 , Edited by admin on Sat Dec 16 08:37:16 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP