UNPD28162
AlkaPlorer ID: AK014486
Synonym: None
IUPAC Name: (E)-2-[(3S,6'R,7'S,8'aS)-6'-ethyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoic acid
Structure
SMILES: CC[C@H]1CN2CC[C@@]3(C(O)=NC4=CC=CC=C43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)O
InChI: InChI=1S/C21H26N2O4/c1-3-13-11-23-9-8-21(16-6-4-5-7-17(16)22-20(21)26)18(23)10-14(13)15(12-27-2)19(24)25/h4-7,12-14,18H,3,8-11H2,1-2H3,(H,22,26)(H,24,25)/b15-12+/t13-,14-,18-,21-/m0/s1
InChIKey: IQSFEAHJUMVILC-RCDYFXNXSA-N
Source
Properties Information
Molecule Weight: 370.4490000000002
TPSA？: 82.36
MolLogP？: 3.261300000000001
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
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