3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-3,4-Dihydroxy-6-Methyl-5-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyloxan-2-Yl]Oxyoxan-2-Yl]Oxymethyl]-3,4,5-Trihydroxyoxan-2-Yl]Oxy-5-Hydroxy-2-(4-Hydroxyphenyl)-7-Methoxychromen-4-One
[CAS# 73519-10-5]

Identification

• Name: 3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-3,4-Dihydroxy-6-Methyl-5-[(2S,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyloxan-2-Yl]Oxyoxan-2-Yl]Oxymethyl]-3,4,5-Trihydroxyoxan-2-Yl]Oxy-5-Hydroxy-2-(4-Hydroxyphenyl)-7-Methoxychromen-4-One
• Synonyms: 3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4S,5R,6S)-3,4-Dihydroxy-6-Methyl-5-[(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,4S,5R,6S)-3,4-Dihydroxy-6-Methyl-5-[[(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,4S,5R,6S)-3,4-Dihydroxy-6-Methyl-5-[(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: 73519-10-5
• SMILES: [C@H]4(OC1=C(OC2=C(C1=O)C(=CC(=C2)OC)O)C3=CC=C(O)C=C3)[C@@H]([C@@H](O)[C@H]([C@H](O4)CO[C@H]5[C@@H]([C@H](O)[C@H]([C@@H](O5)C)O[C@H]6[C@@H]([C@H](O)[C@H]([C@@H](O6)C)O)O)O)O)O
• InChI: 1S/C34H42O19/c1-11-20(37)23(40)26(43)33(48-11)52-29-12(2)49-32(28(45)25(29)42)47-10-18-21(38)24(41)27(44)34(51-18)53-31-22(39)19-16(36)8-15(46-3)9-17(19)50-30(31)13-4-6-14(35)7-5-13/h4-9,11-12,18,20-21,23-29,32-38,40-45H,10H2,1-3H3/t11-,12-,18+,20-,21-,23+,24-,25-,26+,27+,28+,29-,32+,33-,34-/m0/s1
• InChIKey: CGNAHCOLJLGPEQ-PAODLKMBSA-N

Properties

• Density: 1.682g/cm³ (Cal.)
• Boiling point: 1047.587°C at 760 mmHg (Cal.)
• Flash point: 328.027°C (Cal.)