(-)-N-Methylelmerrillicine
AlkaPlorer ID: AK000457
Synonym: None
IUPAC Name: (12R)-7-methoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1,6,8(20),14(19),15,17-hexaen-18-ol
Structure
SMILES: CN1CCC2=C3[C@H]1CC4=C(C3=C5C(=C2OC)OCO5)C(=CC=C4)O
InChI: InChI=1S/C19H19NO4/c1-20-7-6-11-15-12(20)8-10-4-3-5-13(21)14(10)16(15)18-19(17(11)22-2)24-9-23-18/h3-5,12,21H,6-9H2,1-2H3/t12-/m1/s1
InChIKey: OAEXGVZBEFKLHD-GFCCVEGCSA-N
Reference
Alcaloïdes des Annonacees LXXII, Alcaloïdes du Guatteria sagotiana
PubChem CID: 183899
CAS: 107882-27-9
Source
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Properties Information
Molecule Weight: 325.364
TPSA？: 51.160000000000004
MolLogP？: 2.881600000000001
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 5
Activities Information
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