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Details

Stereochemistry ACHIRAL
Molecular Formula C15H16O4
Molecular Weight 260.2851
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HOMOBALDRINAL

SMILES

CC(C)CC(=O)OCC1=COC=C2C(C=O)=CC=C12

InChI

InChIKey=LTVSLKWNAZKBEX-UHFFFAOYSA-N
InChI=1S/C15H16O4/c1-10(2)5-15(17)19-8-12-7-18-9-14-11(6-16)3-4-13(12)14/h3-4,6-7,9-10H,5,8H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C15H16O4
Molecular Weight 260.2851
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:21:34 GMT 2023
Edited
by admin
on Sat Dec 16 11:21:34 GMT 2023
Record UNII
D5Y2TR4PC7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HOMOBALDRINAL
Common Name English
BUTANOIC ACID, 3-METHYL-, (7-FORMYLCYCLOPENTA(C)PYRAN-4-YL)METHYL ESTER
Systematic Name English
(7-FORMYLCYCLOPENTA(C)PYRAN-4-YL)METHYL 3-METHYLBUTANOATE
Systematic Name English
Code System Code Type Description
CAS
67910-07-0
Created by admin on Sat Dec 16 11:21:34 GMT 2023 , Edited by admin on Sat Dec 16 11:21:34 GMT 2023
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PUBCHEM
49999
Created by admin on Sat Dec 16 11:21:34 GMT 2023 , Edited by admin on Sat Dec 16 11:21:34 GMT 2023
PRIMARY
FDA UNII
D5Y2TR4PC7
Created by admin on Sat Dec 16 11:21:34 GMT 2023 , Edited by admin on Sat Dec 16 11:21:34 GMT 2023
PRIMARY
EPA CompTox
DTXSID40218127
Created by admin on Sat Dec 16 11:21:34 GMT 2023 , Edited by admin on Sat Dec 16 11:21:34 GMT 2023
PRIMARY