OntologieschebiclassesCHEBI:52646   
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leptomycin B
http://purl.obolibrary.org/obo/CHEBI_52646

A leptomycin having a (2E,10E,12E,16Z,18E)-double bond configuration as well as an ethyl substituent at position 17.

Also appears infypoectophiposlmgo + 1
Exact Synonyms
(2E,5S,6R,7S,9R,10E,12E,15R,16Z,18E)-17-ethyl-6-hydroxy-3,5,7,9,11,15-hexamethyl-19-[(2S,3S)-3-methyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]-8-oxononadeca-2,10,12,16,18-pentaenoic acid
Related Synonyms
antibiotic ATS 1287B
Antibiotic CI 940
Antibiotic CL 1957A
Antibiotic PD 114720
ATS 1287B
LMB
class Information
charge

0

formula

C33H48O6

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C33H48O6/c1-9-28(14-15-29-24(5)13-16-31(36)39-29)19-22(3)12-10-11-21(2)17-25(6)32(37)27(8)33(38)26(7)18-23(4)20-30(34)35/h10-11,13-17,19-20,22,24-27,29,33,38H,9,12,18H2,1-8H3,(H,34,35)/b11-10+,15-14+,21-17+,23-20+,28-19-/t22-,24+,25-,26+,27-,29+,33-/m1/s1

inchikey

YACHGFWEQXFSBS-XYERBDPFSA-N

in_subset

3_STAR

mass

540.73060

monoisotopicmass

540.34509

smiles

CC\C(\C=C\[C@@H]1OC(=O)C=C[C@@H]1C)=C\[C@H](C)C\C=C\C(\C)=C\[C@@H](C)C(=O)[C@@H](C)[C@H](O)[C@@H](C)C\C(C)=C\C(O)=O

class Relations