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Details

Stereochemistry ACHIRAL
Molecular Formula C22H28O4
Molecular Weight 356.4553
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 7
Charge 0

SHOW SMILES / InChI
Structure of CROCETIN DIMETHYL ESTER

SMILES

COC(=O)C(\C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)OC

InChI

InChIKey=OXNHRKGZZFWUQZ-QORFUXSJSA-N
InChI=1S/C22H28O4/c1-17(13-9-15-19(3)21(23)25-5)11-7-8-12-18(2)14-10-16-20(4)22(24)26-6/h7-16H,1-6H3/b8-7+,13-9+,14-10+,17-11+,18-12+,19-15+,20-16+

HIDE SMILES / InChI

Molecular Formula C22H28O4
Molecular Weight 356.4553
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 7
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:09:16 GMT 2023
Edited
by admin
on Sat Dec 16 10:09:16 GMT 2023
Record UNII
604TT10Y72
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CROCETIN DIMETHYL ESTER
MI  
Common Name English
CROCETIN DIMETHYL ESTER [MI]
Common Name English
2,4,6,8,10,12,14-HEXADECAHEPTAENEDIOIC ACID, 2,6,11,15-TETRAMETHYL-, 1,16-DIMETHYL ESTER, (2E,4E,6E,8E,10E,12E,14E)-
Systematic Name English
TRANS-CROCETIN, DIMETHYL ESTER
Common Name English
DIMETHYLCROCETIN
Common Name English
.GAMMA.-CROCETIN
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID801316719
Created by admin on Sat Dec 16 10:09:16 GMT 2023 , Edited by admin on Sat Dec 16 10:09:16 GMT 2023
PRIMARY
FDA UNII
604TT10Y72
Created by admin on Sat Dec 16 10:09:16 GMT 2023 , Edited by admin on Sat Dec 16 10:09:16 GMT 2023
PRIMARY
PUBCHEM
5316132
Created by admin on Sat Dec 16 10:09:16 GMT 2023 , Edited by admin on Sat Dec 16 10:09:16 GMT 2023
PRIMARY
MERCK INDEX
m3849
Created by admin on Sat Dec 16 10:09:16 GMT 2023 , Edited by admin on Sat Dec 16 10:09:16 GMT 2023
PRIMARY Merck Index
CAS
5892-54-6
Created by admin on Sat Dec 16 10:09:16 GMT 2023 , Edited by admin on Sat Dec 16 10:09:16 GMT 2023
PRIMARY