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BMS-192548

Go to external page http://purl.obolibrary.org/obo/CHEBI_133806

A member of the class of tetracyclines with formula C21H18O9, originally isolated from Aspergillus niger.

Term info

Label

BMS-192548

Synonyms
  • 2-acetyl-3,4a,10,12,12a-pentahydroxy-8-methoxy-4a,12a-dihydrotetracene-1,11(4H,5H)-dione
database cross reference
Subsets

3_STAR

IUPAC NAME
2-acetyl-3,4a,10,12,12a-pentahydroxy-8-methoxy-4a,12a-dihydrotetracene-1,11(4H,5H)-dione [ IUPAC ]

charge

0

formula

C21H18O9

has obo namespace

chebi_ontology

id

CHEBI:133806

inchi

InChI=1S/C21H18O9/c1-8(22)14-13(24)7-20(28)6-10-3-9-4-11(30-2)5-12(23)15(9)17(25)16(10)19(27)21(20,29)18(14)26/h3-5,23-24,27-29H,6-7H2,1-2H3

inchikey

CIWXXQSJBGNZNJ-UHFFFAOYSA-N

mass

414.363

monoisotopicmass

414.09508

smiles

C=1(C2=C(C=C(C1)OC)C=C3C(C2=O)=C(C4(C(C3)(CC(=C(C4=O)C(C)=O)O)O)O)O)O