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CHEBI:188678 - asperdiazapinone A

ChEBI IDCHEBI:188678
ChEBI Nameasperdiazapinone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H25N3O3
Net Charge0
Average Mass403.482
Monoisotopic Mass403.18959
SMILES[H][C@@]12C[C@@]3(C(C)(C)C=C)c4ccc(OC)cc4N[C@@]3([H])N1C(=O)c1ccccc1NC2=O
InChIInChI=1S/C24H25N3O3/c1-5-23(2,3)24-13-19-20(28)25-17-9-7-6-8-15(17)21(29)27(19)22(24)26-18-12-14(30-4)10-11-16(18)24/h5-12,19,22,26H,1,13H2,2-4H3,(H,25,28)/t19-,22-,24+/m0/s1
InChIKeyFCEVLFGWAZSGTN-NGYIFUPDSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
asperdiazapinone A (CHEBI:188678) is a pyrroloindole (CHEBI:48133)
IUPAC Name 
(2S,10R,12S)-6-methoxy-10-(2-methylbut-3-en-2-yl)-1,3,14-triazapentacyclo[10.9.0.02,10.04,9.015,20]henicosa-4(9),5,7,15,17,19-hexaene-13,21-dione
Manual XrefsDatabases
30900767ChemSpider