131573-90-5 , Camelliaside B, Cas:131573-90-5

131573-90-5 , Camelliaside B
Cas:131573-90-5
C32H38O19 / 726.63
MFCD28988580

Camelliaside B

Camelliaside B is a chemical compound that belongs to the group of flavonol glycosides. It has multiple-reaction monitoring (MRM) capabilities, which can be used to detect the presence of flavonols in a sample. MRM is an analytical technique that uses mass spectrometry and monitors specific reactions for the presence of a particular molecule or group of molecules, such as flavonoids. Camelliaside B inhibits the proliferation of fat cells and also has anti-inflammatory properties, as it inhibits pro-inflammatory cytokines like IL-6. This compound also has molecular modeling and glycosidic bond properties.

CAS Number	131573-90-5
Product Name	5,7-dihydroxy-3-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2-(4-hydroxyphenyl)chromen-4-one
IUPAC Name	5,7-dihydroxy-3-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2-(4-hydroxyphenyl)chromen-4-one
Molecular Formula	C32H38O19
Molecular Weight	726.63 g/mol
InChI	InChI=1S/C32H38O19/c1-10-19(38)23(42)25(44)31(46-10)49-27-21(40)17(8-33)48-32(29(27)51-30-24(43)20(39)15(37)9-45-30)50-28-22(41)18-14(36)6-13(35)7-16(18)47-26(28)11-2-4-12(34)5-3-11/h2-7,10,15,17,19-21,23-25,27,29-40,42-44H,8-9H2,1H3/t10-,15+,17+,19-,20-,21+,23+,24+,25+,27-,29+,30-,31-,32+/m0/s1
InChI Key	LLPRITPJQPQXIR-BVDHFOMSSA-N
SMILES	CC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(CO3)O)O)O)OC4=C(OC5=CC(=CC(=C5C4=O)O)O)C6=CC=C(C=C6)O)CO)O)O)O)O
Synonyms	camelliaside B, k-Xyl-Rha-Glu, kampferol 3-O-(2-O-xylopyranosyl-6-O-rhamnopyranosyl)glucopyranoside
Canonical SMILES	CC1C(C(C(C(O1)OC2C(C(OC(C2OC3C(C(C(CO3)O)O)O)OC4=C(OC5=CC(=CC(=C5C4=O)O)O)C6=CC=C(C=C6)O)CO)O)O)O)O
Isomeric SMILES	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H](O[C@@H]([C@@H]2O[C@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O)OC4=C(OC5=CC(=CC(=C5C4=O)O)O)C6=CC=C(C=C6)O)CO)O)O)O)O