(12S)-16-hydroxy-15-methoxy-1-methyl-5,7-dioxa-1-azapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-2(10),3,8,13(18),14,16-hexaen-1-ium
AlkaPlorer ID: AK278894
Synonym: None
IUPAC Name: (1R,12S)-15-methoxy-1-methyl-5,7-dioxa-1-azoniapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-16-ol
Structure
SMILES: COC1=CC2=C(C=C1O)CC[N@@+]1(C)C3=CC4=C(C=C3C[C@@H]21)OCO4
InChI: InChI=1S/C19H19NO4/c1-20-4-3-11-6-16(21)17(22-2)8-13(11)15(20)5-12-7-18-19(9-14(12)20)24-10-23-18/h6-9,15H,3-5,10H2,1-2H3/p+1/t15-,20-/m0/s1
InChIKey: GQIZBMAOHHBERD-YWZLYKJASA-O
Reference
Alkaloids of Cryptocarya phyllostemon
PubChem CID: 14378045
LOTUS: LTS0091066
SuperNatural Ⅲ: SN0112583-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
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Properties Information
Molecule Weight: 326.37200000000007
TPSA？: 47.92
MolLogP？: 2.9201000000000006
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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