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novobiocin

Go to external page http://purl.obolibrary.org/obo/CHEBI_28368

A coumarin-derived antibiotic obtained from Streptomyces niveus.

Term info

Label

novobiocin

Synonyms
  • Novobiocin
database cross reference
Subsets

3_STAR

INN
novobiocinum [ DrugBank ]

INN
novobiocine [ DrugBank ]

INN
novobiocina [ DrugBank ]

charge

0

formula

C31H36N2O11

has alternative id

CHEBI:44505, CHEBI:7644, CHEBI:25597

has obo namespace

chebi_ontology

has related synonym

N-{7-[(3-O-carbamoyl-6-deoxy-5-methyl-4-O-methyl-beta-D-gulopyranosyl)oxy]-4-hydroxy-8-methyl-2-oxo-2H-chromen-3-yl}-4-hydroxy-3-(3-methylbut-2-en-1-yl)benzamide, novobiocina, novobiocinum, novobiocine

id

CHEBI:28368

inchi

InChI=1S/C31H36N2O11/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37)/t23-,25+,26-,29-/m1/s1

inchikey

YJQPYGGHQPGBLI-KGSXXDOSSA-N

mass

612.62430

monoisotopicmass

612.23191

smiles

CO[C@@H]1[C@@H](OC(N)=O)[C@@H](O)[C@H](Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2C)OC1(C)C