(2S,3S,3aR,9bR)-7-(1-cyclopentenyl)-3-(hydroxymethyl)-6-oxo-1-[1-oxo-2-(3-pyridinyl)ethyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester (CHEBI:98799)

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CHEBI:98799 - (2S,3S,3aR,9bR)-7-(1-cyclopentenyl)-3-(hydroxymethyl)-6-oxo-1-[1-oxo-2-(3-pyridinyl)ethyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester

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ChEBI ID	CHEBI:98799
ChEBI Name	(2S,3S,3aR,9bR)-7-(1-cyclopentenyl)-3-(hydroxymethyl)-6-oxo-1-[1-oxo-2-(3-pyridinyl)ethyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester
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Last Modified	9 March 2018
Downloads	Molfile

Formula	C25H27N3O5
Net Charge	0
Average Mass	449.507
Monoisotopic Mass	449.19507
SMILES	COC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@@H]2N1C(=O)Cc1cccnc1
InChI	InChI=1S/C25H27N3O5/c1-33-25(32)23-19(14-29)18-13-27-20(9-8-17(24(27)31)16-6-2-3-7-16)22(18)28(23)21(30)11-15-5-4-10-26-12-15/h4-6,8-10,12,18-19,22-23,29H,2-3,7,11,13-14H2,1H3/t18-,19-,22+,23-/m0/s1
InChIKey	MVZYZZDTAGMQFB-LBVMUVSTSA-N

ChEBI Ontology

Outgoing Relation(s)
	(2S,3S,3aR,9bR)-7-(1-cyclopentenyl)-3-(hydroxymethyl)-6-oxo-1-[1-oxo-2-(3-pyridinyl)ethyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester (CHEBI:98799) is a methyl ester (CHEBI:25248)
	(2S,3S,3aR,9bR)-7-(1-cyclopentenyl)-3-(hydroxymethyl)-6-oxo-1-[1-oxo-2-(3-pyridinyl)ethyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester (CHEBI:98799) is a organic heterotricyclic compound (CHEBI:26979)
	(2S,3S,3aR,9bR)-7-(1-cyclopentenyl)-3-(hydroxymethyl)-6-oxo-1-[1-oxo-2-(3-pyridinyl)ethyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester (CHEBI:98799) is a tertiary carboxamide (CHEBI:140326)

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