1,2,3,8,9,10-Hexahydroxyaporphine; (S)-form, 1,2:8,9-Bis(methylene), 3,10-di-Me ether
AlkaPlorer ID: AK300349
Synonym: 4a,5,6,7-Tetrahydro-8,13-dimethoxy-5-methyl-4H-bis[1,3]benzodioxolo[6,5,4-de:5',4'-g]quinoline, 3,10-Dimethoxy-1,2:8,9-bis(methylenedioxy)aporphine, Ocotominarine
IUPAC Name: 4,17-dimethoxy-13-methyl-6,8,19,21-tetraoxa-13-azahexacyclo[10.10.1.02,10.05,9.016,23.018,22]tricosa-1(22),2,4,9,16(23),17-hexaene
Structure
SMILES: COC1=CC2=C(CC3C4=C(CCN3C)C(OC)=C3OCOC3=C24)C2=C1OCO2
InChI: InChI=1S/C21H21NO6/c1-22-5-4-10-15-13(22)6-12-11(7-14(23-2)19-18(12)25-8-26-19)16(15)20-21(17(10)24-3)28-9-27-20/h7,13H,4-6,8-9H2,1-3H3
InChIKey: SOBPDDCRKOMPSD-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ocotea minarum | Ocotea | Lauraceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 383.4000000000002
TPSA？: 58.620000000000005
MolLogP？: 2.9133000000000013
Number of H-Donors: 0
Number of H-Acceptors: 7
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|