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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H32O3
Molecular Weight 296.4449
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-DIMORPHECOLIC ACID, (9R)-

SMILES

CCCCC\C=C/C=C/[C@H](O)CCCCCCCC(O)=O

InChI

InChIKey=NPDSHTNEKLQQIJ-WXUVIADPSA-N
InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H32O3
Molecular Weight 296.4449
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:46:54 GMT 2023
Edited
by admin
on Sat Dec 16 12:46:54 GMT 2023
Record UNII
G6CFV4K3WV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-DIMORPHECOLIC ACID, (9R)-
Common Name English
10,12-OCTADECADIENOIC ACID, 9-HYDROXY-, (9R,10E,12Z)-
Systematic Name English
(9R,10E,12Z)-9-HYDROXY-10,12-OCTADECADIENOIC ACID
Systematic Name English
9R-HODE
Common Name English
(9R)-9-HYDROXYOCTADECA-10E,12Z-DIENOIC ACID
Systematic Name English
Code System Code Type Description
FDA UNII
G6CFV4K3WV
Created by admin on Sat Dec 16 12:46:54 GMT 2023 , Edited by admin on Sat Dec 16 12:46:54 GMT 2023
PRIMARY
CHEBI
78730
Created by admin on Sat Dec 16 12:46:54 GMT 2023 , Edited by admin on Sat Dec 16 12:46:54 GMT 2023
PRIMARY
PUBCHEM
16061059
Created by admin on Sat Dec 16 12:46:54 GMT 2023 , Edited by admin on Sat Dec 16 12:46:54 GMT 2023
PRIMARY
EPA CompTox
DTXSID20723587
Created by admin on Sat Dec 16 12:46:54 GMT 2023 , Edited by admin on Sat Dec 16 12:46:54 GMT 2023
PRIMARY
CAS
10075-11-3
Created by admin on Sat Dec 16 12:46:54 GMT 2023 , Edited by admin on Sat Dec 16 12:46:54 GMT 2023
PRIMARY
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