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lonchocarpenin

Go to external page http://purl.obolibrary.org/obo/CHEBI_6521

A hydroxycoumarin that is 2H,8H-benzo[1,2-b:5,4-b']dipyran-2-one substituted by a hydroxy group at position 4, a methoxy group at position 5, 4-methoxyphenyl group at position 3 and two methyl groups at position 8 respectively.

Term info

Label

lonchocarpenin

Synonyms
  • 4-hydroxy-5-methoxy-3-(4-methoxyphenyl)-8,8-dimethyl-10-(3-methylbut-2-en-1-yl)-2H,8H-benzo[1,2-b:5,4-b']dipyran-2-one
database cross reference
Subsets

3_STAR

IUPAC NAME
4-hydroxy-5-methoxy-3-(4-methoxyphenyl)-8,8-dimethyl-10-(3-methylbut-2-en-1-yl)-2H,8H-benzo[1,2-b:5,4-b']dipyran-2-one [ IUPAC ]

charge

0

formula

C27H28O6

has obo namespace

chebi_ontology

id

CHEBI:6521

inchi

InChI=1S/C27H28O6/c1-15(2)7-12-18-23-19(13-14-27(3,4)33-23)24(31-6)21-22(28)20(26(29)32-25(18)21)16-8-10-17(30-5)11-9-16/h7-11,13-14,28H,12H2,1-6H3

inchikey

CCYKXDPVYWRNMH-UHFFFAOYSA-N

mass

448.50760

monoisotopicmass

448.18859

smiles

COc1ccc(cc1)-c1c(O)c2c(OC)c3C=CC(C)(C)Oc3c(CC=C(C)C)c2oc1=O