Speranculatine B
AlkaPlorer ID: AK090507
Synonym: 'speranculatine A', 'speranculatine B', 'Speranculatine A', '(+)-Speranculatine A', '(+)-Speranculatine B'
IUPAC Name: (3R)-3-hydroxy-5-[(5R)-5-hydroxy-4-methoxy-1-methyl-2,6-dioxo-5-(2-oxopropyl)pyridin-3-yl]-4-methoxy-1-methyl-3-(2-oxopropyl)pyridine-2,6-dione
Structure
SMILES: COC1=C(C2=C(OC)[C@](O)(CC(C)=O)C(=O)N(C)C2=O)C(=O)N(C)C(=O)[C@@]1(O)CC(C)=O
InChI: InChI=1S/C20H24N2O10/c1-9(23)7-19(29)13(31-5)11(15(25)21(3)17(19)27)12-14(32-6)20(30,8-10(2)24)18(28)22(4)16(12)26/h29-30H,7-8H2,1-6H3/t19-,20-/m1/s1
InChIKey: XPTWLIFSBXWZNJ-WOJBJXKFSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Speranskia tuberculata | Speranskia | Euphorbiaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 452.4160000000003
TPSA？: 167.81999999999996
MolLogP？: -1.7949999999999977
Number of H-Donors: 2
Number of H-Acceptors: 10
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|