CHEBI:102175 - (2S,3S,3aR,9bR)-1-[cyclopropyl(oxo)methyl]-3-(hydroxymethyl)-6-oxo-7-phenyl-N-(2-pyridin-4-ylethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

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ChEBI Name (2S,3S,3aR,9bR)-1-[cyclopropyl(oxo)methyl]-3-(hydroxymethyl)-6-oxo-7-phenyl-N-(2-pyridin-4-ylethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
ChEBI ID CHEBI:102175
Stars This entity has been manually annotated by a third party.
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Formula C29H30N4O4
Net Charge 0
Average Mass 498.574
Monoisotopic Mass 498.22671
InChI InChI=1S/C29H30N4O4/c34-17-23-22-16-32-24(9-8-21(29(32)37)19-4-2-1-3-5-19)25(22)33(28(36)20-6-7-20)26(23)27(35)31-15-12-18-10-13-30-14-11-18/h1-5,8-11,13-14,20,22-23,25-26,34H,6-7,12,15-17H2,(H,31,35)/t22-,23-,25+,26-/m0/s1
InChIKey OYSHQHUZVWGKJD-LJCOXQHRSA-N
SMILES C1CC1C(=O)N2[C@@H]3[C@@H](CN4C3=CC=C(C4=O)C5=CC=CC=C5)[C@@H]([C@H]2C(=O)NCCC6=CC=NC=C6)CO
ChEBI Ontology
Outgoing (2S,3S,3aR,9bR)-1-[cyclopropyl(oxo)methyl]-3-(hydroxymethyl)-6-oxo-7-phenyl-N-(2-pyridin-4-ylethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide (CHEBI:102175) is a phenylpyridine (CHEBI:38193)
Manual Xref Database
LSM-13533 LINCS
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