Calceolarioside A

Category	Human immunodeficiency Virus (HIV)
CAS	84744-28-5
Description	Calceolarioside A is a natural compound which can be isolated from Ajuga becumbens Thunb, showing potent activity against visceral leishmaniasis.

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Synonyms	Calceolarioside A;84744-28-5;Calceolarioside;[(2R,3S,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate;CHEMBL481635;beta-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-;MEGxp0_000507;ACon1_000369;CHEBI:177500;DTXSID001316527;BDBM50259819;AKOS040761446;FS-9819;NCGC00169142-01;DA-62001;XC180735;HY-123896;Calceolarioside A, >=95% (LC/MS-ELSD);CS-0086776;NS00097240;[(2R,3S,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-4,5-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate;beta-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 4-O-[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]-;
IUPAC Name	[(2R,3S,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Molecular Weight	506.6
Molecular Formula	C32H30N2O4
Canonical SMILES	CC(C)(C=C)C1=C(C2=CC=CC=C2N1)C3=C(C(=O)C(=C(C3=O)O)C4=C(NC5=CC=CC=C54)C(C)(C)C=C)O
InChI	InChI=1S/C23H26O11/c24-11-18-22(34-19(29)6-3-12-1-4-14(25)16(27)9-12)20(30)21(31)23(33-18)32-8-7-13-2-5-15(26)17(28)10-13/h1-6,9-10,18,20-28,30-31H,7-8,11H2/b6-3+/t18-,20-,21-,22-,23-/m1/s1
InChIKey	UHIGZYLCYRQESL-VJWFJHQPSA-N
Purity	98%
Solubility	DMSO, Pyridine, Methanol, Ethanol, etc.
Appearance	Powder
Storage	Please store the product under the recommended conditions in the Certificate of Analysis.