(5R,6R,8aS)-2-oxidanyl-6-[(1S)-1-oxidanyl-3-phenylmethoxy-propyl]-5-[3-(phenylsulfonyl)propyl]-2,5,6,7,8,8a-hexahydro-1H-indolizin-3-one

Systemtic Name: (5R,6R,8aS)-2-oxidanyl-6-[(1S)-1-oxidanyl-3-phenylmethoxy-propyl]-5-[3-(phenylsulfonyl)propyl]-2,5,6,7,8,8a-hexahydro-1H-indolizin-3-one Openeye Name: (5R,6R,8aS)-5-[3-(benzenesulfonyl)propyl]-6-[(1S)-3-benzyloxy-1-hydroxy-propyl]-2-hydroxy-2,5,6,7,8,8a-hexahydro-1H-indolizin-3-one CAS Name: (5R,6R,8aS)-5-[3-(benzenesulfonyl)propyl]-2-hydroxy-6-[(1S)-1-hydroxy-3-phenylmethoxypropyl]-2,5,6,7,8,8a-hexahydro-1H-indolizin-3-one IUPAC Name: (5R,6R,8aS)-5-[3-(benzenesulfonyl)propyl]-2-hydroxy-6-[(1S)-1-hydroxy-3-phenylmethoxypropyl]-2,5,6,7,8,8a-hexahydro-1H-indolizin-3-one Traditional Name: (5R,6R,8aS)-6-[(1S)-3-benzoxy-1-hydroxy-propyl]-5-(3-besylpropyl)-2-hydroxy-indolizidin-3-one Formula: C27H35NO6S MolecularWeight: 501.6349

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(N2C1CC(C2=O)O)CCCS(=O)(=O)C3=CC=CC=C3)C(CCOCC4=CC=CC=C4)O

Isomeric SMILES

C1C[C@H]([C@H](N2[C@@H]1CC(C2=O)O)CCCS(=O)(=O)C3=CC=CC=C3)[C@H](CCOCC4=CC=CC=C4)O

InChI

InChI=1S/C27H35NO6S/c29-25(15-16-34-19-20-8-3-1-4-9-20)23-14-13-21-18-26(30)27(31)28(21)24(23)12-7-17-35(32,33)22-10-5-2-6-11-22/h1-6,8-11,21,23-26,29-30H,7,12-19H2/t21-,23+,24+,25-,26?/m0/s1