21-Oxogelsevirine
AlkaPlorer ID: AK183181
Synonym: ''
IUPAC Name: (1R,2S,5S,6S,7S,8R,11S)-2-ethenyl-1'-methoxy-4-methylspiro[9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane-7,3'-indole]-2',3-dione
Structure
SMILES: C=C[C@]12C(=O)N(C)[C@@H]3[C@H]4CO[C@H](C[C@H]41)[C@]1(C(=O)N(OC)C4=CC=CC=C41)[C@@H]32
InChI: InChI=1S/C21H22N2O4/c1-4-20-13-9-15-21(12-7-5-6-8-14(12)23(26-3)19(21)25)17(20)16(11(13)10-27-15)22(2)18(20)24/h4-8,11,13,15-17H,1,9-10H2,2-3H3/t11-,13+,15+,16+,17-,20-,21-/m0/s1
InChIKey: LZUOAJIWRAAAGN-FQUOGTQPSA-N
Reference
21-Oxogelsevirine, a New Alkaloid from Gelsemium rankinii
PubChem CID: 162876182
LOTUS: LTS0056340
SuperNatural Ⅲ: SN0219850-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Gelsemium rankinii | Gelsemium | Gelsemiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 366.4170000000001
TPSA？: 59.08
MolLogP？: 1.5100999999999996
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|