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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H20O3
Molecular Weight 248.3175
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEHYDROIPOMEAMARONE

SMILES

CC(C)=CC(=O)C[C@]1(C)CC[C@@H](O1)C2=COC=C2

InChI

InChIKey=QQYXBLIHHIHFCW-CABCVRRESA-N
InChI=1S/C15H20O3/c1-11(2)8-13(16)9-15(3)6-4-14(18-15)12-5-7-17-10-12/h5,7-8,10,14H,4,6,9H2,1-3H3/t14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H20O3
Molecular Weight 248.3175
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 11:39:23 GMT 2023
Edited
by admin
on Sat Dec 16 11:39:23 GMT 2023
Record UNII
T822N232NM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEHYDROIPOMEAMARONE
Common Name English
IPOMEAMARONE, DEHYDRO-
Common Name English
4-METHYL-1-((2R,5S)-2,3,4,5-TETRAHYDRO-5-METHYL(2,3'-BIFURAN)-5-YL)-3-PENTEN-2-ONE
Systematic Name English
3-PENTEN-2-ONE, 4-METHYL-1-(2,3,4,5-TETRAHYDRO-5-METHYL(2,3'-BIFURAN)-5-YL)-, (2R-CIS)-
Systematic Name English
Code System Code Type Description
CAS
52691-02-8
Created by admin on Sat Dec 16 11:39:23 GMT 2023 , Edited by admin on Sat Dec 16 11:39:23 GMT 2023
PRIMARY
PUBCHEM
92143153
Created by admin on Sat Dec 16 11:39:23 GMT 2023 , Edited by admin on Sat Dec 16 11:39:23 GMT 2023
PRIMARY
FDA UNII
T822N232NM
Created by admin on Sat Dec 16 11:39:23 GMT 2023 , Edited by admin on Sat Dec 16 11:39:23 GMT 2023
PRIMARY