Terminology Service for NFDI4Health
JSON

lehualide I

Go to external page http://purl.obolibrary.org/obo/CHEBI_68009

A member of the class of 2-pyranones that is 2H-pyran-2-one substituted by methoxy groups at positions 3 and 4, a methyl group at position 5 and a 10-(methylsulfanyl)decyl group at position 6. Isolated from the marine sponge of the genus Plakortis, it exhibits cytotoxicity against human promyeloid leukemic HL-60 cells.

Term info

Label

lehualide I

Synonyms
  • 3,4-dimethoxy-5-methyl-6-[10-(methylsulfanyl)decyl]-2H-pyran-2-one
database cross reference
Subsets

3_STAR

IUPAC NAME
3,4-dimethoxy-5-methyl-6-[10-(methylsulfanyl)decyl]-2H-pyran-2-one [ IUPAC ]

charge

0

formula

C19H32O4S

has obo namespace

chebi_ontology

id

CHEBI:68009

inchi

InChI=1S/C19H32O4S/c1-15-16(23-19(20)18(22-3)17(15)21-2)13-11-9-7-5-6-8-10-12-14-24-4/h5-14H2,1-4H3

inchikey

KEAOWFVPPJUFOW-UHFFFAOYSA-N

mass

356.52000

monoisotopicmass

356.20213

smiles

COc1c(C)c(CCCCCCCCCCSC)oc(=O)c1OC