Molecule

Melithiazol B

AlkaPlorer ID: AK001302

Synonym: 'Melithiazole B', 'Melithiazol B'

IUPAC Name: methyl (2E,4R,5S,6E)-3,5-dimethoxy-4-methyl-7-[2-(2-prop-1-en-2-yl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]hepta-2,6-dienoate

Structure

SMILES: C=C(C)C1=NC(C2=NC(/C=C/[C@H](OC)[C@@H](C)/C(=C\C(=O)OC)OC)=CS2)=CS1

InChI: InChI=1S/C20H24N2O4S2/c1-12(2)19-22-15(11-28-19)20-21-14(10-27-20)7-8-16(24-4)13(3)17(25-5)9-18(23)26-6/h7-11,13,16H,1H2,2-6H3/b8-7+,17-9+/t13-,16+/m1/s1

InChIKey: MIUFOGFASQSNPX-ZVJWTWILSA-N

Reference

Polyphenolic compounds in the fruits of Egyptian medicinal plants (Terminalia bellerica, Terminalia chebula and Terminalia horrida): Characterization, quantitation and determination of antioxidant capacities

PubChem CID: 10502239

SuperNatural Ⅲ: SN0226832-04

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain

Properties Information

Molecule Weight: 420.55600000000015

TPSA？: 70.54

MolLogP？: 4.6673000000000044

Number of H-Donors: 0

Number of H-Acceptors: 8

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi