OntologieschebiclassesCHEBI:66135   
JSON document
kalimantacin A
http://purl.obolibrary.org/obo/CHEBI_66135

A fatty acid derivative isolated from the fermentation broth of Alcaligenes sp. YL-02632S. It is an antibiotic with antibacterial activity.

Also appears inslm
Exact Synonyms
(2E,10Z,12E)-20-{[3-(carbamoyloxy)-2-methylbutanoyl]amino}-19-hydroxy-3,5,15-trimethyl-7-methylidene-17-oxoicosa-2,10,12-trienoic acid
class Information
charge

0

formula

C30H48N2O7

has_dbxref
has_obo_namespace

chebi_ontology

inchi

InChI=1S/C30H48N2O7/c1-20(14-22(3)15-23(4)17-28(35)36)12-10-8-7-9-11-13-21(2)16-26(33)18-27(34)19-32-29(37)24(5)25(6)39-30(31)38/h7-9,11,17,21-22,24-25,27,34H,1,10,12-16,18-19H2,2-6H3,(H2,31,38)(H,32,37)(H,35,36)/b8-7-,11-9+,23-17+

inchikey

GENAAYFYLGYPIQ-JOPGMDTFSA-N

in_subset

3_STAR

mass

548.71130

monoisotopicmass

548.34615

smiles

CC(C\C=C\C=C/CCC(=C)CC(C)C\C(C)=C\C(O)=O)CC(=O)CC(O)CNC(=O)C(C)C(C)OC(N)=O

class Relations