Argemonine; (-)-form, O2,O9-Di-de-Me
AlkaPlorer ID: AK289189
Synonym: 2,9-Dihydroxy-3,8-dimethoxypavinane, Bisnorargemonine, Rotundine
IUPAC Name: 5,12-dimethoxy-17-methyl-17-azatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4,6,10,12,14-hexaene-4,13-diol
Structure
SMILES: COC1=CC2=C(C=C1O)C1CC3=CC(O)=C(OC)C=C3C(C2)N1C
InChI: InChI=1S/C19H21NO4/c1-20-14-4-10-6-16(21)19(24-3)9-13(10)15(20)5-11-7-18(23-2)17(22)8-12(11)14/h6-9,14-15,21-22H,4-5H2,1-3H3
InChIKey: JLYWCHLTLCGOMW-UHFFFAOYSA-N
Reference
Secondary and tertiary isoquinoline alkaloids from Xylopia parviflora
PubChem CID: 288120
CAS: 6808-63-5
LOTUS: LTS0255189
COCONUT: CNP0294934.3
Source
Properties Information
Molecule Weight: 327.38000000000005
TPSA?: 62.16
MolLogP?: 2.9414000000000016
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
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