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CHEBI:175299 - Dihydroxyfumitremorgin C

ChEBI IDCHEBI:175299
ChEBI NameDihydroxyfumitremorgin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H25N3O5
Net Charge0
Average Mass411.458
Monoisotopic Mass411.17942
SMILESCOc1ccc2c3c(nc2c1)C(C=C(C)C)N1C(=O)C2CCCN2C(=O)C1(O)C3O
InChIInChI=1S/C22H25N3O5/c1-11(2)9-16-18-17(13-7-6-12(30-3)10-14(13)23-18)19(26)22(29)21(28)24-8-4-5-15(24)20(27)25(16)22/h6-7,9-10,15-16,19,23,26,29H,4-5,8H2,1-3H3
InChIKeyCPHRCQUGNAGVIB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Dihydroxyfumitremorgin C (CHEBI:175299) is a β-carbolines (CHEBI:60834)
IUPAC Name 
1,2-dihydroxy-7-methoxy-12-(2-methylprop-1-enyl)-10,13,19-triazapentacyclo[11.7.0.03,11.04,9.015,19]icosa-3(11),4(9),5,7-tetraene-14,20-dione
Manual XrefsDatabases
35014608ChemSpider
HMDB0038581HMDB