Cajanone structure

Cajanone

7-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5-hydroxy-2,2-dimethyl-7,8-dihydropyrano[3,2-g]chromen-6-one

Also Known As: CAJANONE|NCI60_002437|2H,6H-Benzo(1,2-b:5,4-b')dipyran-6-one, 7-(2,4-dihydroxy-5-(3-methyl-2-buten-1-yl)phenyl)-7,8-dihydro-5-hydroxy-2,2-dimethyl-|7-(2,4-Dihydroxy-5-(3-methyl-2-buten-1-yl)phenyl)-7,8-dihydro-5-hydroxy-2,2-dimethyl-2H,6H-benzo(1,2-b:5,4-b')dipyran-6-one|7-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5-hydroxy-2,2-dimethyl-7,8-dihydropyrano[3,2-g]chromen-6-one|3-[2,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-5-hydroxy-8,8-dimethyl-2H,3H,4H,8H-pyrano[3,2-g]chromen-4-one|7-(2,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl)-5-hydroxy-2,2-dimethyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-6-one|7-[2,4-Dihydroxy-5- phenyl]-7,8-dihydro-5-hydroxy-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one|7-[2,4-Dihydroxy-5-(3-methyl-2-buten-1-yl)phenyl]-7,8-dihydro-5-hydroxy-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-ba(2)]dipyran-6-one|7-[2,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl ]-7,8-dihydro-5-hydroxy-2,2-dimethyl-2h,6h-benzo[1,2-b:5,4-b']dipyran-6-one|7-[2,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-7,8-dihydro-5-hydroxy-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b ]dipyran-6-one|7-[2,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-7,8-dihydro-5-hydroxy-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one, 9CI

CAS: 63006-48-4
Molecular Formula C25H26O6
Molecular Weight 422.17294 g/mol
LogP 5.4
Topological Polar Surface Area 96.2 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 6
Rotatable Bonds 3
Exact Mass 422.17294
Monoisotopic Mass 422.17294
Heavy Atoms 31
Complexity 738.0

Chemical Identifiers

CAS Number 63006-48-4
SMILES CC(=CCC1=CC(=C(C=C1O)O)C2COC3=C(C2=O)C(=C4C=CC(OC4=C3)(C)C)O)C
InChIKey BAKSOIVZFARRJC-UHFFFAOYSA-N

Product Overview

Cajanone (CAS 63006-48-4), with molecular formula C25H26O6 and molecular weight 422.17294 g/mol. IUPAC: 7-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5-hydroxy-2,2-dimethyl-7,8-dihydropyrano[3,2-g]chromen-6-one.

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