Isocephalotaxine
AlkaPlorer ID: AK029311
Synonym: None
IUPAC Name: (6S)-3-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),2,13,15(19)-tetraen-4-ol
Structure
SMILES: COC1=C2C3=CC4=C(C=C3CCN3CCC[C@]23CC1O)OCO4
InChI: InChI=1S/C18H21NO4/c1-21-17-13(20)9-18-4-2-5-19(18)6-3-11-7-14-15(23-10-22-14)8-12(11)16(17)18/h7-8,13,20H,2-6,9-10H2,1H3/t13?,18-/m0/s1
InChIKey: PQWZXENVZQJUKV-UWBLVGDVSA-N
Reference
New Alkaloids from <i>Cephalotaxus </i><i>f</i><i>ortunei</i>
PubChem CID: 10245167
LOTUS: LTS0144863
NPASS: NPC165797
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cephalotaxus fortunei | Cephalotaxus | Taxaceae | Cupressales | Pinopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 315.369
TPSA？: 51.16000000000001
MolLogP？: 1.9281
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | KB | IC50 | 15.0 | ug.mL-1 | 10.1021/np0203178 |