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CHEBI:201991 - Pseudonocardian B

ChEBI IDCHEBI:201991
ChEBI NamePseudonocardian B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20N2O5
Net Charge0
Average Mass356.378
Monoisotopic Mass356.13722
SMILESCC[C@]1(O)C[C@@]2(O)c3c(c(C)cc(=O)n3C)C(=O)c3c(C)cc(=O)n1c32
InChIInChI=1S/C19H20N2O5/c1-5-18(25)8-19(26)16-13(9(2)6-11(22)20(16)4)15(24)14-10(3)7-12(23)21(18)17(14)19/h6-7,25-26H,5,8H2,1-4H3/t18-,19+/m0/s1
InChIKeyWVPWAWQSZCUQGO-RBUKOAKNSA-N
Species of MetaboliteComponentSourceComments
Pseudonocardia antitumoralis (ncbitaxon:1070982) - PubMed (21892356)
ChEBI Ontology
Outgoing Relation(s)
Pseudonocardian B (CHEBI:201991) is a indoles (CHEBI:24828)
IUPAC Name 
(1R,14S)-14-ethyl-1,14-dihydroxy-3,6,10-trimethyl-3,13-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),5,9(16),10-tetraene-4,8,12-trione
Manual XrefsDatabases
27025686ChemSpider