Simmondsin; Di-O-de-Me, 4-benzoyl
AlkaPlorer ID: AK313546
Synonym: Lanceolin B
IUPAC Name: None
Structure
SMILES: N#C/C=C1/C(OC2OC(CO)C(O)C(O)C2O)CC(OC(=O)C2=CC=CC=C2)C(O)C1O
InChI: InChI=1S/C21H25NO10/c22-7-6-11-12(31-21-19(28)18(27)17(26)14(9-23)32-21)8-13(16(25)15(11)24)30-20(29)10-4-2-1-3-5-10/h1-6,12-19,21,23-28H,8-9H2/b11-6-
InChIKey: KGOYILLMEBWCAQ-WDZFZDKYSA-N
Reference
CAS: 151197-19-2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lophira lanceolata | Lophira | Ochnaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 451.42800000000017
TPSA？: 189.93
MolLogP？: -2.0274199999999984
Number of H-Donors: 6
Number of H-Acceptors: 11
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|