2-Ethyl-3-methyl-2-butenedioic acid; (Z)-form, Imide, N-β-D-glucopyranoside
AlkaPlorer ID: AK197833
Synonym: None
IUPAC Name: 3-ethyl-4-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]pyrrole-2,5-dione
Structure
SMILES: CCC1=C(C)C(=O)N(C2OC(CO)C(O)C(O)C2O)C1=O
InChI: InChI=1S/C13H19NO7/c1-3-6-5(2)11(19)14(12(6)20)13-10(18)9(17)8(16)7(4-15)21-13/h7-10,13,15-18H,3-4H2,1-2H3
InChIKey: IPUNBNMYMPOIEC-UHFFFAOYSA-N
Reference
Bumaldosides A, B and C from the Leaves of Staphylea bumalda
PubChem CID: 154791048
LOTUS: LTS0039383
COCONUT: CNP0332134
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Garcinia mangostana | Garcinia | Clusiaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Microtropis japonica | Microtropis | Celastraceae | Celastrales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 301.295
TPSA？: 127.53
MolLogP？: -2.1183999999999994
Number of H-Donors: 4
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|