Rhamnocitrin 3-O-beta-D-rhamninoside
[CAS# 39723-40-5]

Identification

• Name: Rhamnocitrin 3-O-beta-D-rhamninoside
• Synonyms: 3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R,5S,6S)-3,5-Dihydroxy-6-Methyl-4-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxymethyl]-3,4,5-Trihydroxy-Tetrahydropyran-2-Yl]Oxy-5-Hydroxy-2-(4-Hydroxyphenyl)-7-Methoxy-Chromen-4-One; 3-[[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R,5S,6S)-3,5-Dihydroxy-6-Methyl-4-[[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxymethyl]-3,4,5-Trihydroxy-2-Tetrahydropyranyl]Oxy]-5-Hydroxy-2-(4-Hydroxyphenyl)-7-Methoxy-4-Chromenone; 3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R,5S,6S)-3,5-Dihydroxy-6-Methyl-4-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxymethyl]-3,4,5-Trihydroxy-Tetrahydropyran-2-Yl]Oxy-5-Hydroxy-2-(4-Hydroxyphenyl)-7-Methoxy-Chromone
• Molecular Formula: C₃₄H₄₂O₁₉
• Molecular Weight: 754.69
• CAS Registry Number: 39723-40-5
• SMILES: [C@@H]5([C@H]([C@H](OC[C@@H]4[C@H](O)[C@@H]([C@H]([C@H](OC2=C(OC1=CC(=CC(=C1C2=O)O)OC)C3=CC=C(C=C3)O)O4)O)O)O[C@H]([C@@H]5O)C)O)O[C@H]6[C@@H]([C@H](O)[C@H]([C@@H](O6)C)O)O
• InChI: 1S/C34H42O19/c1-11-20(37)24(41)26(43)33(49-11)52-30-21(38)12(2)48-32(28(30)45)47-10-18-22(39)25(42)27(44)34(51-18)53-31-23(40)19-16(36)8-15(46-3)9-17(19)50-29(31)13-4-6-14(35)7-5-13/h4-9,11-12,18,20-22,24-28,30,32-39,41-45H,10H2,1-3H3/t11-,12-,18+,20-,21-,22-,24+,25-,26+,27+,28+,30+,32+,33-,34-/m0/s1
• InChIKey: MQMTVWHXCSRCER-BZPRNGGBSA-N

Properties

• Density: 1.682g/cm³ (Cal.)
• Boiling point: 1061.361°C at 760 mmHg (Cal.)
• Flash point: 332.418°C (Cal.)