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CHEBI:126271 - (1S)-1-(hydroxymethyl)-7-methoxy-N-propyl-1'-(2-thiazolylmethyl)-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]carboxamide

ChEBI IDCHEBI:126271
ChEBI Name(1S)-1-(hydroxymethyl)-7-methoxy-N-propyl-1'-(2-thiazolylmethyl)-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]carboxamide
Stars
DownloadsMolfile
FormulaC25H33N5O3S
Net Charge0
Average Mass483.638
Monoisotopic Mass483.23041
SMILESCCCNC(=O)N1CC2(CCN(Cc3nccs3)CC2)c2c(nc3cc(OC)ccc23)[C@H]1CO
InChIInChI=1S/C25H33N5O3S/c1-3-8-27-24(32)30-16-25(6-10-29(11-7-25)14-21-26-9-12-34-21)22-18-5-4-17(33-2)13-19(18)28-23(22)20(30)15-31/h4-5,9,12-13,20,28,31H,3,6-8,10-11,14-16H2,1-2H3,(H,27,32)/t20-/m1/s1
InChIKeyXWZFCLMJCTZCMR-HXUWFJFHSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
(1S)-1-(hydroxymethyl)-7-methoxy-N-propyl-1'-(2-thiazolylmethyl)-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]carboxamide (CHEBI:126271) is a harmala alkaloid (CHEBI:61379)
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