Terminology Service for NFDI4Health

mitomycin B

Go to external page http://purl.obolibrary.org/obo/CHEBI_85416


A member of the family of mitomycins that exhibits antibiotic and antitumour properties.

Term info

Label

mitomycin B

Synonyms
  • [(1aS,8R,8aR,8bS)-8a-hydroxy-6-methoxy-1,5-dimethyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl carbamate
database cross reference
Subsets

3_STAR

IUPAC NAME
[(1aS,8R,8aR,8bS)-8a-hydroxy-6-methoxy-1,5-dimethyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl carbamate [ IUPAC ]

charge

0

formula

C16H19N3O6

has obo namespace

chebi_ontology

id

CHEBI:85416

inchi

InChI=1S/C16H19N3O6/c1-6-11(20)10-9(12(21)13(6)24-3)7(5-25-15(17)22)16(23)14-8(18(14)2)4-19(10)16/h7-8,14,23H,4-5H2,1-3H3,(H2,17,22)/t7-,8-,14-,16+,18?/m0/s1

inchikey

UZUUQCBCWDBYCG-DQRAMIIBSA-N

mass

349.33860

monoisotopicmass

349.12739

smiles

COC1=C(C)C(=O)C2=C([C@H](COC(N)=O)[C@@]3(O)[C@@H]4[C@H](CN23)N4C)C1=O