Vinorine
AlkaPlorer ID: AK355582
Synonym: None
IUPAC Name: [(10S,12R,16S,17S,18R)-13-ethylidene-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
Structure
SMILES: CC=C1CN2[C@H]3C[C@@H]1[C@@H]1[C@@H](OC(C)=O)C4(C[C@@H]12)C3=NC1=CC=CC=C14
InChI: InChI=1S/C21H22N2O2/c1-3-12-10-23-16-8-13(12)18-17(23)9-21(20(18)25-11(2)24)14-6-4-5-7-15(14)22-19(16)21/h3-7,13,16-18,20H,8-10H2,1-2H3/t13-,16-,17-,18-,20+,21?/m0/s1
InChIKey: CLDVMRAEPFQOSD-FBWKIBSESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Rauvolfia caffra | Rauvolfia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 334.419
TPSA？: 41.9
MolLogP？: 2.9947000000000017
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|