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lissoclibadin 2

Go to external page http://purl.obolibrary.org/obo/CHEBI_66580

An organosulfur heterocyclic compound isolated from the ascidian Lissoclinum badium. It has been shown to exhibit cytotoxicity against human cancer cell lines.

Term info

Label

lissoclibadin 2

Synonyms
  • 2,2'-[3,4,9,10-tetramethoxy-2,8-bis(methylsulfanyl)dibenzo[c,f][1,2,5]trithiepine-1,7-diyl]bis(N,N-dimethylethanamine)
database cross reference
Subsets

3_STAR

IUPAC NAME
2,2'-[3,4,9,10-tetramethoxy-2,8-bis(methylsulfanyl)dibenzo[c,f][1,2,5]trithiepine-1,7-diyl]bis(N,N-dimethylethanamine) [ IUPAC ]

charge

0

formula

C26H38N2O4S5

has obo namespace

chebi_ontology

id

CHEBI:66580

inchi

InChI=1S/C26H38N2O4S5/c1-27(2)13-11-15-21(33-9)18(30-6)20(32-8)26-23(15)35-25-19(31-7)17(29-5)22(34-10)16(12-14-28(3)4)24(25)36-37-26/h11-14H2,1-10H3

inchikey

MGWYCLOYGLKCFF-UHFFFAOYSA-N

mass

602.91600

monoisotopicmass

602.14351

smiles

COc1c(OC)c2ssc3c(CCN(C)C)c(SC)c(OC)c(OC)c3sc2c(CCN(C)C)c1SC