Terminology Service for NFDI4Health
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phomalevone A

Go to external page http://purl.obolibrary.org/obo/CHEBI_68297

A biaryl that is 5,5',10a,10a'-tetrahydro-9H,9'H-2,2'-bixanthene-9,9'-dione substituted by hydroxy groups at positions 1, 1', 5, 5', 8 and 8' and methyl groups at positions 3, 3', 10a and 10a'. Isolated from the cultures of a Hawaiian isolate of the fungus Phoma species, it exhibits antibacterial activity.

Term info

Label

phomalevone A

Synonyms
  • (5S,5'S,10aR,10a'R)-1,1',5,5',8,8'-hexahydroxy-3,3',10a,10a'-tetramethyl-5,5',10a,10a'-tetrahydro-9H,9'H-2,2'-bixanthene-9,9'-dione
database cross reference
Subsets

3_STAR

IUPAC NAME
(5S,5'S,10aR,10a'R)-1,1',5,5',8,8'-hexahydroxy-3,3',10a,10a'-tetramethyl-5,5',10a,10a'-tetrahydro-9H,9'H-2,2'-bixanthene-9,9'-dione [ IUPAC ]

charge

0

formula

C30H26O10

has obo namespace

chebi_ontology

id

CHEBI:68297

inchi

InChI=1S/C30H26O10/c1-11-9-15-21(27(37)23-13(31)5-7-17(33)29(23,3)39-15)25(35)19(11)20-12(2)10-16-22(26(20)36)28(38)24-14(32)6-8-18(34)30(24,4)40-16/h5-10,17-18,31-36H,1-4H3/t17-,18-,29-,30-/m0/s1

inchikey

KMDRWTGFZLUZEY-NEUGYGHLSA-N

mass

546.52140

monoisotopicmass

546.15260

smiles

Cc1cc2O[C@@]3(C)[C@@H](O)C=CC(O)=C3C(=O)c2c(O)c1-c1c(C)cc2O[C@@]3(C)[C@@H](O)C=CC(O)=C3C(=O)c2c1O