85719-78-4
AlkaPlorer ID: AK077502
Synonym: '', '92282-10-5', 'Sesbanimide B', 'Sesbanimide A', '(+)-Sesbanimide A'
IUPAC Name: 4-[(4R,5S,6R)-5-hydroxy-6-[(2R,3R)-2-hydroxy-3-methyl-4-methylideneoxolan-2-yl]-1,3-dioxan-4-yl]piperidine-2,6-dione
Structure
SMILES: C=C1CO[C@@](O)([C@@H]2OCO[C@H](C3CC(=O)N=C(O)C3)[C@@H]2O)[C@@H]1C
InChI: InChI=1S/C15H21NO7/c1-7-5-23-15(20,8(7)2)14-12(19)13(21-6-22-14)9-3-10(17)16-11(18)4-9/h8-9,12-14,19-20H,1,3-6H2,2H3,(H,16,17,18)/t8-,12+,13-,14-,15-/m1/s1
InChIKey: ULQATHQJWVNXEJ-AXNXFRROSA-N
Reference
Sesbanimide A and related tumor inhibitors from Sesbania drummondii: Structure and chemistry
PubChem CID: 162959773
LOTUS: LTS0201670
SuperNatural Ⅲ: SN0373702-07
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Sesbania drummondii | Sesbania | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 327.333
TPSA？: 117.81000000000002
MolLogP？: -0.1070000000000006
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|