Cepharanthine; 1,2,3,4-Tetradehydro, N2-de-Me, N2'-β-oxide
AlkaPlorer ID: AK291944
Synonym: (+)-1,3,4-Dehydrocepharanthine-2'β-N-oxide
IUPAC Name: 22,33-dimethoxy-13-methyl-13-oxido-2,5,7,20-tetraoxa-28-aza-13-azoniaoctacyclo[25.6.2.216,19.13,10.121,25.04,8.031,35.014,39]nonatriaconta-1(33),3(39),4(8),9,16(38),17,19(37),21,23,25(36),27,29,31,34-tetradecaene
Structure
SMILES: COC1=CC=C2C=C1OC1=CC=C(C=C1)CC1C3=C(C=C4OCOC4=C3OC3=C(OC)C=C4C=CN=C(C2)C4=C3)CC[N+]1(C)[O-]
InChI: InChI=1S/C36H32N2O7/c1-38(39)13-11-24-18-33-35(43-20-42-33)36-34(24)28(38)15-21-4-7-25(8-5-21)44-31-16-22(6-9-29(31)40-2)14-27-26-19-32(45-36)30(41-3)17-23(26)10-12-37-27/h4-10,12,16-19,28H,11,13-15,20H2,1-3H3
InChIKey: IBCKZXBUVZLHNI-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stephania epigaea | Stephania | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 604.6590000000002
TPSA？: 91.33
MolLogP？: 7.253800000000007
Number of H-Donors: 0
Number of H-Acceptors: 8
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|