3-[(1S,2R,4aR,8aR)-2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carbonyl]-5-[(1R,4S,5R,7R)-4,7-dihydroxy-6-oxabicyclo[3.1.1]heptan-1-yl]-1,4-dihydroxypyridin-2-one
AlkaPlorer ID: AK553643
Synonym: None
IUPAC Name: 5-(4,7-dihydroxy-6-oxabicyclo[3.1.1]heptan-1-yl)-1,4-dihydroxy-3-(2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carbonyl)pyridin-2-one
Structure
SMILES: CC1C=CC2CCCCC2C1C(=O)C1=C(O)C(C23CCC(O)C(O2)C3O)=CN(O)C1=O
InChI: InChI=1S/C23H29NO7/c1-11-6-7-12-4-2-3-5-13(12)16(11)19(27)17-18(26)14(10-24(30)22(17)29)23-9-8-15(25)20(31-23)21(23)28/h6-7,10-13,15-16,20-21,25-26,28,30H,2-5,8-9H2,1H3
InChIKey: VWTPXSZEHJMEGW-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 431.4850000000002
TPSA？: 129.22000000000003
MolLogP？: 1.7120999999999995
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|