Isodomesticine
AlkaPlorer ID: AK063651
Synonym: '(+)-1-Methoxy-2-hydroxy-9,10-methylenedioxyaporphine'
IUPAC Name: (12S)-19-methoxy-13-methyl-5,7-dioxa-13-azapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(20),2,4(8),9,16,18-hexaen-18-ol
Structure
SMILES: COC1=C(O)C=C2CCN(C)[C@H]3CC4=CC5=C(C=C4C1=C23)OCO5
InChI: InChI=1S/C19H19NO4/c1-20-4-3-10-6-14(21)19(22-2)18-12-8-16-15(23-9-24-16)7-11(12)5-13(20)17(10)18/h6-8,13,21H,3-5,9H2,1-2H3/t13-/m0/s1
InChIKey: OGJUMNZGTZWIBO-ZDUSSCGKSA-N
Reference
Minor Alkaloids From<i>Guatteria dumetorum</i>with Antileishmanial Activity
PubChem CID: 15690954
LOTUS: LTS0253292
NPASS: NPC218742
Source
Properties Information
Molecule Weight: 325.3640000000001
TPSA？: 51.16000000000001
MolLogP？: 2.881600000000001
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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