Catharinensine
AlkaPlorer ID: AK026858
Synonym: None
IUPAC Name: methyl 2-[(3R,6'R,7'R,8'aR)-6'-ethyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]prop-2-enoate
Structure
SMILES: C=C(C(=O)OC)[C@@H]1C[C@H]2N(CC[C@]23C(O)=NC2=CC=CC=C23)C[C@@H]1CC
InChI: InChI=1S/C21H26N2O3/c1-4-14-12-23-10-9-21(16-7-5-6-8-17(16)22-20(21)25)18(23)11-15(14)13(2)19(24)26-3/h5-8,14-15,18H,2,4,9-12H2,1,3H3,(H,22,25)/t14-,15-,18+,21+/m0/s1
InChIKey: ZGOYSFPFTZNFQT-PVMRSWARSA-N
Reference
Catharinensine, an oxindole alkaloid from Peschiera catharinensis
PubChem CID: 162925311
LOTUS: LTS0002155
SuperNatural Ⅲ: SN0469807-04
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Tabernaemontana catharinensis | Tabernaemontana | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 354.4500000000001
TPSA？: 62.13
MolLogP？: 3.375600000000002
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|