UNPD23343
AlkaPlorer ID: AK544370
Synonym: None
IUPAC Name: (1R,10S,13E,16S)-13-ethylidene-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-trien-18-ol
Structure
SMILES: C/C=C1/CN2[C@H]3C[C@@]45C6=CC=CC=C6N(C)C4[C@@H]2CC1C3C5O
InChI: InChI=1S/C20H24N2O/c1-3-11-10-22-15-8-12(11)17-16(22)9-20(19(17)23)13-6-4-5-7-14(13)21(2)18(15)20/h3-7,12,15-19,23H,8-10H2,1-2H3/b11-3-/t12?,15-,16-,17?,18?,19?,20+/m0/s1
InChIKey: VBEQZFNVRMPLSM-KCFUIBDGSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Rauvolfia sumatrana | Rauvolfia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 308.425
TPSA？: 26.71
MolLogP？: 2.156200000000001
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|