Cathaphylline
AlkaPlorer ID: AK291820
Synonym: Methyl 2,3-didehydro-21-hydroxy-20-oxoaspidospermidine-3-carboxylate
IUPAC Name: None
Structure
SMILES: COC(=O)C1=C2NC3=CC=CC=C3C23CCN2CCCC(C(=O)CO)(C1)C23
InChI: InChI=1S/C21H24N2O4/c1-27-18(26)13-11-20(16(25)12-24)7-4-9-23-10-8-21(19(20)23)14-5-2-3-6-15(14)22-17(13)21/h2-3,5-6,19,22,24H,4,7-12H2,1H3
InChIKey: MYQDASJUFYICEH-UHFFFAOYSA-N
Reference
CAS: 59444-63-2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Catharanthus trichophyllus | Catharanthus | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 368.43300000000016
TPSA？: 78.87
MolLogP？: 1.5965999999999998
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|