U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C17H18O2
Molecular Weight 254.3236
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 4
Charge 0

SHOW SMILES / InChI
Structure of 2,4,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-phenyl-, (all-E)-

SMILES

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

InChI

InChIKey=NKNLZEWAZSQQCV-HSOKICSZSA-N
InChI=1S/C17H18O2/c1-14(7-6-8-15(2)13-17(18)19)11-12-16-9-4-3-5-10-16/h3-13H,1-2H3,(H,18,19)/b8-6+,12-11+,14-7+,15-13+

HIDE SMILES / InChI

Molecular Formula C17H18O2
Molecular Weight 254.3236
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 Sat Dec 16 10:57:43 GMT 2023
Edited
by admin
on Sat Dec 16 10:57:43 GMT 2023
Record UNII
LT3YAG7WU2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,4,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-phenyl-, (all-E)-
Common Name English
Ro-8-8717
Code English
3,7-Dimethyl-9-phenyl-2,4,6,8-nonatetraenoic acid, (2E,4E,6E,8E)-
Systematic Name English
2,4,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-phenyl-, (2E,4E,6E,8E)-
Systematic Name English
(2E,4E,6E,8E)-3,7-Dimethyl-9-phenyl-2,4,6,8-nonatetraenoic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
6438148
Created by admin on Sat Dec 16 10:57:43 GMT 2023 , Edited by admin on Sat Dec 16 10:57:43 GMT 2023
PRIMARY
FDA UNII
LT3YAG7WU2
Created by admin on Sat Dec 16 10:57:43 GMT 2023 , Edited by admin on Sat Dec 16 10:57:43 GMT 2023
PRIMARY
CAS
55079-84-0
Created by admin on Sat Dec 16 10:57:43 GMT 2023 , Edited by admin on Sat Dec 16 10:57:43 GMT 2023
PRIMARY
EPA CompTox
DTXSID501174205
Created by admin on Sat Dec 16 10:57:43 GMT 2023 , Edited by admin on Sat Dec 16 10:57:43 GMT 2023
PRIMARY