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CHEBI:98871 - (2R,3R,3aS,9bS)-1-(2-cyclopropyl-1-oxoethyl)-3-(hydroxymethyl)-6-oxo-7-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester

ChEBI IDCHEBI:98871
ChEBI Name(2R,3R,3aS,9bS)-1-(2-cyclopropyl-1-oxoethyl)-3-(hydroxymethyl)-6-oxo-7-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester
Stars
Last Modified9 March 2018
DownloadsMolfile
FormulaC24H26N2O5
Net Charge0
Average Mass422.481
Monoisotopic Mass422.18417
SMILESCOC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4ccccc4)c3=O)[C@H]2N1C(=O)CC1CC1
InChIInChI=1S/C24H26N2O5/c1-31-24(30)22-18(13-27)17-12-25-19(21(17)26(22)20(28)11-14-7-8-14)10-9-16(23(25)29)15-5-3-2-4-6-15/h2-6,9-10,14,17-18,21-22,27H,7-8,11-13H2,1H3/t17-,18-,21+,22-/m1/s1
InChIKeyGLQBIINCSVPTPJ-RPHTVSPISA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3R,3aS,9bS)-1-(2-cyclopropyl-1-oxoethyl)-3-(hydroxymethyl)-6-oxo-7-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester (CHEBI:98871) is a organic heterotricyclic compound (CHEBI:26979)
(2R,3R,3aS,9bS)-1-(2-cyclopropyl-1-oxoethyl)-3-(hydroxymethyl)-6-oxo-7-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester (CHEBI:98871) is a tertiary carboxamide (CHEBI:140326)
Synonym  Source
BRD-K30155575LINCS
Manual XrefsDatabases
LSM-10250LINCS