None
AlkaPlorer ID: AK324281
Synonym: None
IUPAC Name: (5R)-5-[(1S,3R,4R)-9-butyl-3-hydroxy-4-methyl-2,14-dioxa-10-azapentacyclo[6.5.1.01,5.06,10.09,13]tetradecan-3-yl]-5-hydroxy-4-methoxy-3-methylfuran-2-one
Structure
SMILES: CCCCC12C3CC4C5[C@@H](C)[C@](O)([C@]6(O)OC(=O)C(C)=C6OC)O[C@]5(O3)C1CCN42
InChI: InChI=1S/C22H31NO7/c1-5-6-8-19-14-7-9-23(19)13-10-15(19)28-20(14)16(13)12(3)21(25,30-20)22(26)17(27-4)11(2)18(24)29-22/h12-16,25-26H,5-10H2,1-4H3/t12-,13?,14?,15?,16?,19?,20-,21-,22-/m1/s1
InChIKey: QRPLLGRSWMMQCB-CDCSEKQPSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stemona aphylla | Stemona | Stemonaceae | Pandanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 421.4900000000002
TPSA？: 97.69
MolLogP？: 1.2552
Number of H-Donors: 2
Number of H-Acceptors: 8
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | Unchecked | MIC | 1.188 | nM | 10.1021/np100137h |