CHEBI:101508 - (2S,3S,3aR,9bR)-3-(hydroxymethyl)-6-oxo-7-phenyl-1-(2-pyridinylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester

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ChEBI Name (2S,3S,3aR,9bR)-3-(hydroxymethyl)-6-oxo-7-phenyl-1-(2-pyridinylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester
ChEBI ID CHEBI:101508
Stars This entity has been manually annotated by a third party.
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Formula C25H25N3O4
Net Charge 0
Average Mass 431.485
Monoisotopic Mass 431.18451
InChI InChI=1S/C25H25N3O4/c1-32-25(31)23-20(15-29)19-14-27-21(22(19)28(23)13-17-9-5-6-12-26-17)11-10-18(24(27)30)16-7-3-2-4-8-16/h2-12,19-20,22-23,29H,13-15H2,1H3/t19-,20-,22+,23-/m0/s1
InChIKey HHLLHWFWRSRSTM-RLBLXZPPSA-N
SMILES COC(=O)[C@@H]1[C@H]([C@@H]2CN3C(=CC=C(C3=O)C4=CC=CC=C4)[C@@H]2N1CC5=CC=CC=N5)CO
ChEBI Ontology
Outgoing (2S,3S,3aR,9bR)-3-(hydroxymethyl)-6-oxo-7-phenyl-1-(2-pyridinylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester (CHEBI:101508) is a α-amino acid ester (CHEBI:46874)
Manual Xref Database
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