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CHEBI:217366 - Bafilomycin M

ChEBI IDCHEBI:217366
ChEBI NameBafilomycin M
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H60O8
Net Charge0
Average Mass620.868
Monoisotopic Mass620.42882
SMILESCO[C@H]1/C=C/C=C(\C)C[C@H](C)[C@H](O)[C@H](C)/C=C(C)/C=C(\C)C(=O)O[C@@H]1[C@@H](C)[C@@H](O)[C@H](C)[C@@]1(OC)C[C@@H](O)[C@H](C)[C@@H](C(C)C)O1
InChIInChI=1S/C36H60O8/c1-20(2)33-26(8)29(37)19-36(42-12,44-33)28(10)32(39)27(9)34-30(41-11)15-13-14-21(3)16-23(5)31(38)24(6)17-22(4)18-25(7)35(40)43-34/h13-15,17-18,20,23-24,26-34,37-39H,16,19H2,1-12H3/b15-13+,21-14+,22-17+,25-18+/t23-,24+,26-,27-,28-,29+,30-,31-,32+,33+,34+,36+/m0/s1
InChIKeyRKUVBVJPAMVHBK-FQXKNZMXSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1016/j.tetlet.2016.09.066)
ChEBI Ontology
Outgoing Relation(s)
Bafilomycin M (CHEBI:217366) is a macrolide (CHEBI:25106)
IUPAC Name 
(3E,5E,7R,8S,9S,11E,13E,15S,16R)-8-hydroxy-16-[(2S,3R,4S)-3-hydroxy-4-[(2R,4R,5S,6R)-4-hydroxy-2-methoxy-5-methyl-6-propan-2-yloxan-2-yl]pentan-2-yl]-15-methoxy-3,5,7,9,11-pentamethyl-1-oxacyclohexadeca-3,5,11,13-tetraen-2-one
Manual XrefsDatabases
58197324ChemSpider