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| IUPAC Name: | (E)-3-(3-hydroxy-4-methoxyphenyl)-1-[2-hydroxy-6-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]prop-2-en-1-one |
| Description: | Hesperidin methyl chalcone (CAS# 24292-52-2) is a flavonoid agent used in the treatment of venous insufficiency. |
| Molecular Weight: | 624.59 |
| Molecular Formula: | C29H36O15 |
| Canonical SMILES: | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C(C(=C3)OC)C(=O)C=CC4=CC(=C(C=C4)OC)O)O)O)O)O)O)O)O |
| InChI: | InChI=1S/C29H36O15/c1-12-22(33)24(35)26(37)28(42-12)41-11-20-23(34)25(36)27(38)29(44-20)43-14-9-17(32)21(19(10-14)40-3)15(30)6-4-13-5-7-18(39-2)16(31)8-13/h4-10,12,20,22-29,31-38H,11H2,1-3H3/b6-4+/t12-,20+,22-,23+,24+,25-,26+,27+,28+,29+/m0/s1 |
| InChI Key: | FDHNLHLOJLLXDH-JIYHLSBYSA-N |
| Boiling Point: | 953 °C at 760 mmHg |
| Melting Point: | 120°C (dec.)(lit.) |
| Flash Point: | 309.5°C |
| Purity: | 95% UV |
| Density: | 1.57 g/cm3 |
| Appearance: | Yellow powder |
| MDL: | MFCD00010438 |
| LogP: | -0.95840 |
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(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
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