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Details

Stereochemistry RACEMIC
Molecular Formula C15H20O4
Molecular Weight 264.3169
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of ABSCISIC ACID, (±)-(2Z,4E)-

SMILES

CC(\C=C\C1(O)C(C)=CC(=O)CC1(C)C)=C\C(O)=O

InChI

InChIKey=JLIDBLDQVAYHNE-LXGGSRJLSA-N
InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-

HIDE SMILES / InChI

Molecular Formula C15H20O4
Molecular Weight 264.3169
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 09:53:36 GMT 2023
Edited
by admin
on Sat Dec 16 09:53:36 GMT 2023
Record UNII
3B18Y5RNGK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ABSCISIC ACID, (±)-(2Z,4E)-
Common Name English
2,4-PENTADIENOIC ACID, 5-(1-HYDROXY-2,6,6-TRIMETHYL-4-OXO-2-CYCLOHEXEN-1-YL)-3-METHYL-, (2Z,4E)-
Systematic Name English
(±)-ABA
Common Name English
(±)-ABSCISIC ACID
Common Name English
(±)-(CIS,TRANS)-ABSCISIC ACID
Common Name English
PBI-57
Code English
ABSCISIC ACID (±)-CIS,TRANS-FORM [MI]
Common Name English
Code System Code Type Description
PUBCHEM
5375199
Created by admin on Sat Dec 16 09:53:36 GMT 2023 , Edited by admin on Sat Dec 16 09:53:36 GMT 2023
PRIMARY
FDA UNII
3B18Y5RNGK
Created by admin on Sat Dec 16 09:53:36 GMT 2023 , Edited by admin on Sat Dec 16 09:53:36 GMT 2023
PRIMARY
EPA CompTox
DTXSID1030604
Created by admin on Sat Dec 16 09:53:36 GMT 2023 , Edited by admin on Sat Dec 16 09:53:36 GMT 2023
PRIMARY
CAS
14375-45-2
Created by admin on Sat Dec 16 09:53:36 GMT 2023 , Edited by admin on Sat Dec 16 09:53:36 GMT 2023
PRIMARY
MERCK INDEX
m1282
Created by admin on Sat Dec 16 09:53:36 GMT 2023 , Edited by admin on Sat Dec 16 09:53:36 GMT 2023
PRIMARY Merck Index