UNPD435
AlkaPlorer ID: AK542102
Synonym: None
IUPAC Name: [(1S,14R,15Z)-15-ethylidene-3-methyl-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraen-13-yl]methanol
Structure
SMILES: C/C=C1\CN2C3CC4=C([C@@H]2C[C@@H]1C3CO)N(C)C1=CC=CC=C41
InChI: InChI=1S/C20H24N2O/c1-3-12-10-22-18-9-15-13-6-4-5-7-17(13)21(2)20(15)19(22)8-14(12)16(18)11-23/h3-7,14,16,18-19,23H,8-11H2,1-2H3/b12-3+/t14-,16?,18?,19-/m0/s1
InChIKey: UVWQYWHKTZABSO-ALCFZQKKSA-N
Reference
Alcalóides de Peschiera affinis (Muell. Arg) Miers (Apocynaceae)
PubChem CID: 101286222
LOTUS: LTS0114417
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Tabernaemontana hystrix | Tabernaemontana | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 308.425
TPSA？: 28.4
MolLogP？: 3.034400000000001
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|