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CHEBI:220187 - Chrysosporazine M

ChEBI IDCHEBI:220187
ChEBI NameChrysosporazine M
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H30N2O6
Net Charge0
Average Mass526.589
Monoisotopic Mass526.21039
SMILESCOc1cc([C@@H]2[C@H]3CN(C(C)=O)[C@@H](Cc4ccccc4)CN3C(=O)[C@@]23O[C@H]3c2ccccc2)cc2c1OCO2
InChIInChI=1S/C31H30N2O6/c1-19(34)32-17-24-27(22-14-25(36-2)28-26(15-22)37-18-38-28)31(29(39-31)21-11-7-4-8-12-21)30(35)33(24)16-23(32)13-20-9-5-3-6-10-20/h3-12,14-15,23-24,27,29H,13,16-18H2,1-2H3/t23-,24+,27+,29-,31+/m0/s1
InChIKeyCNJPOHZCIZRLEN-JTTXJNPXSA-N
Species of MetaboliteComponentSourceComments
Chrysosporiumspecies (ncbitaxon:40412) - PubMed (31975579)
ChEBI Ontology
Outgoing Relation(s)
Chrysosporazine M (CHEBI:220187) is a benzodioxoles (CHEBI:38298)
IUPAC Name 
(3S,3'S,7R,8R,8aS)-2-acetyl-3-benzyl-8-(7-methoxy-1,3-benzodioxol-5-yl)-3'-phenylspiro[3,4,8,8a-tetrahydro-1H-pyrrolo[1,2-a]pyrazine-7,2'-oxirane]-6-one
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81369493ChemSpider