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

Details

Stereochemistry RACEMIC
Molecular Formula C15H24O2
Molecular Weight 236.3499
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARVYL-3-METHYLBUTYRATE, TRANS-

SMILES

CC(C)CC(=O)O[C@@H]1C[C@H](CC=C1C)C(C)=C

InChI

InChIKey=GGESQBHSIRCDBW-UONOGXRCSA-N
InChI=1S/C15H24O2/c1-10(2)8-15(16)17-14-9-13(11(3)4)7-6-12(14)5/h6,10,13-14H,3,7-9H2,1-2,4-5H3/t13-,14+/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H24O2
Molecular Weight 236.3499
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:32:13 GMT 2023
Edited
by admin
on Sat Dec 16 11:32:13 GMT 2023
Record UNII
07C3WI848K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARVYL-3-METHYLBUTYRATE, TRANS-
Common Name English
Code System Code Type Description
FDA UNII
07C3WI848K
Created by admin on Sat Dec 16 11:32:13 GMT 2023 , Edited by admin on Sat Dec 16 11:32:13 GMT 2023
PRIMARY
PUBCHEM
92202187
Created by admin on Sat Dec 16 11:32:13 GMT 2023 , Edited by admin on Sat Dec 16 11:32:13 GMT 2023
PRIMARY