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CHEBI:220334 - Grincamycin M

ChEBI IDCHEBI:220334
ChEBI NameGrincamycin M
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H32O11
Net Charge0
Average Mass592.597
Monoisotopic Mass592.19446
SMILESCOc1cc2c(c3c1C[C@@](C)(O)CC3=O)C(=O)c1ccc([C@H]3C[C@H]4O[C@H]5CC(=O)[C@H](C)O[C@H]5O[C@@H]4[C@@H](C)O3)c(O)c1C2=O
InChIInChI=1S/C32H32O11/c1-12-18(33)8-23-31(41-12)43-30-13(2)40-21(9-22(30)42-23)14-5-6-15-26(27(14)35)29(37)16-7-20(39-4)17-10-32(3,38)11-19(34)24(17)25(16)28(15)36/h5-7,12-13,21-23,30-31,35,38H,8-11H2,1-4H3/t12-,13+,21+,22+,23-,30+,31-,32+/m0/s1
InChIKeyXGXYYWQMVPTVNO-PSDUXRIHSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (30158647)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
Grincamycin M (CHEBI:220334) is a angucycline (CHEBI:48130)
IUPAC Name 
(3R)-9-[(1R,3R,5S,8S,10R,12R,14R)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.03,8]tetradecan-12-yl]-3,8-dihydroxy-5-methoxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione