Foetidine I; (S)-form, 9-Methoxy
AlkaPlorer ID: AK298484
Synonym: Foetidine II
IUPAC Name: None
Structure
SMILES: CCC(O)(C(=O)OC1=CC=C(/C=C/C(=O)NCCCNCCCCNC(=O)/C=C/C2=CC=C(O)C=C2)C=C1)C1=C(COC(C)=O)C(=O)N2CC3=CC4=C(OC)C=CC=C4N=C3C2=C1
InChI: InChI=1S/C48H51N5O10/c1-4-48(60,39-28-41-45-34(27-37-40(52-45)9-7-10-42(37)61-3)29-53(41)46(58)38(39)30-62-31(2)54)47(59)63-36-19-13-33(14-20-36)16-22-44(57)51-26-8-24-49-23-5-6-25-50-43(56)21-15-32-11-17-35(55)18-12-32/h7,9-22,27-28,49,55,60H,4-6,8,23-26,29-30H2,1-3H3,(H,50,56)(H,51,57)/b21-15+,22-16+
InChIKey: GQXFPFZQRBACPF-YHARCJFQSA-N
Reference
CAS: 173220-98-9
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mappia foetida | Mappia | Icacinaceae | Icacinales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 857.9609999999998
TPSA？: 207.41
MolLogP？: 5.1246000000000045
Number of H-Donors: 5
Number of H-Acceptors: 13
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|