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CHEBI:188558 - trichodermamide A

ChEBI IDCHEBI:188558
ChEBI Nametrichodermamide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20N2O9
Net Charge0
Average Mass432.385
Monoisotopic Mass432.11688
SMILES[H][C@@]12ON=C(C(=O)Nc3cc4ccc(OC)c(OC)c4oc3=O)C[C@]1(O)[C@H](O)C=C[C@H]2O
InChIInChI=1S/C20H20N2O9/c1-28-13-5-3-9-7-10(19(26)30-15(9)16(13)29-2)21-18(25)11-8-20(27)14(24)6-4-12(23)17(20)31-22-11/h3-7,12,14,17,23-24,27H,8H2,1-2H3,(H,21,25)/t12-,14-,17+,20+/m1/s1
InChIKeyZQOKLOPATOTAEE-OVCSSCHWSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
trichodermamide A (CHEBI:188558) is a coumarins (CHEBI:23403)
IUPAC Name 
(4aS,5R,8R,8aS)-N-(7,8-dimethoxy-2-oxochromen-3-yl)-4a,5,8-trihydroxy-4,5,8,8a-tetrahydro-1,2-benzoxazine-3-carboxamide
Manual XrefsDatabases
9158107ChemSpider