(1'R,2'R,3S,5'S,6'S,8'R,11'S)-2'-[(1S)-1-hydroxyethyl]-1-methoxy-4'-methyl-9'-oxa-4'-azaspiro[indole-3,7'-tetracyclo[6.3.1.0²,⁶.0⁵,¹¹]dodecane]-2-one
AlkaPlorer ID: AK026524
Synonym: None
IUPAC Name: (1R,2R,5S,6S,7S,8R,11S)-2-[(1S)-1-hydroxyethyl]-1'-methoxy-4-methylspiro[9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane-7,3'-indole]-2'-one
Structure
SMILES: CON1C(=O)[C@]2(C3=CC=CC=C31)[C@H]1[C@H]3[C@H]4CO[C@@H]2C[C@H]4[C@]1([C@H](C)O)CN3C
InChI: InChI=1S/C21H26N2O4/c1-11(24)20-10-22(2)17-12-9-27-16(8-14(12)20)21(18(17)20)13-6-4-5-7-15(13)23(26-3)19(21)25/h4-7,11-12,14,16-18,24H,8-10H2,1-3H3/t11-,12-,14+,16+,17+,18-,20+,21-/m0/s1
InChIKey: HNTFOMODUWFBCP-JWUDHPFXSA-N
Reference
Three oxindole alkaloids from Gelsemium species
PubChem CID: 14217352
LOTUS: LTS0251949
SuperNatural Ⅲ: SN0130607-04
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Gelsemium sempervirens | Gelsemium | Gelsemiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 370.4490000000001
TPSA？: 62.24
MolLogP？: 1.1783
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|