Pseudoxandrine; 7-Me ether
AlkaPlorer ID: AK311555
Synonym: Pseudoxandrinine
IUPAC Name: 9-hydroxy-6,20,21,25-tetramethoxy-15,30-dimethyl-23-oxa-15,30-diazaheptacyclo[22.6.2.13,7.18,12.114,18.027,31.022,33]pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaen-13-one
Structure
SMILES: COC1=CC2=C3C=C1OC1=C4C(=CC(OC)=C1OC)CCN(C)C4C(=O)C1=CC=C(O)C(=C1)C1=CC(=CC=C1OC)CC3N(C)CC2
InChI: InChI=1S/C38H40N2O7/c1-39-13-11-22-18-31(44-4)32-20-25(22)28(39)16-21-7-10-30(43-3)27(15-21)26-17-24(8-9-29(26)41)36(42)35-34-23(12-14-40(35)2)19-33(45-5)37(46-6)38(34)47-32/h7-10,15,17-20,28,35,41H,11-14,16H2,1-6H3
InChIKey: OUSQOTNZRASOJV-UHFFFAOYSA-N
Reference
Halogenated secondary metabolites from<i>Laurencia Obtusa</i>
PubChem CID: 163022546
COCONUT: CNP0299352.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Pseudoxandra | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 636.745
TPSA？: 89.93
MolLogP？: 6.382900000000008
Number of H-Donors: 1
Number of H-Acceptors: 9
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|