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CHEBI:210111 - Chrysosporazine D

ChEBI IDCHEBI:210111
ChEBI NameChrysosporazine D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC29H30N2O5
Net Charge0
Average Mass486.568
Monoisotopic Mass486.21547
SMILESCOc1cc(C[C@H]2CN(C(C)=O)[C@@H](Cc3ccccc3)CN2C(=O)c2ccccc2)cc2c1OCO2
InChIInChI=1S/C29H30N2O5/c1-20(32)30-17-25(14-22-15-26(34-2)28-27(16-22)35-19-36-28)31(29(33)23-11-7-4-8-12-23)18-24(30)13-21-9-5-3-6-10-21/h3-12,15-16,24-25H,13-14,17-19H2,1-2H3/t24-,25-/m0/s1
InChIKeyFAJQATXXQQHVIW-DQEYMECFSA-N
Species of MetaboliteComponentSourceComments
Chrysosporium (ncbitaxon:40411) - PubMed (31544463)
ChEBI Ontology
Outgoing Relation(s)
Chrysosporazine D (CHEBI:210111) is a benzodioxoles (CHEBI:38298)
IUPAC Name 
1-[(2S,5S)-4-benzoyl-2-benzyl-5-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethanone
Manual XrefsDatabases
77421569ChemSpider