Molecular Structure:
CCD No.:CCD00176604
SOFALCONE
CAS No.:
64506-49-6
Formula:C27 H30 O6
MolWeight:450.528
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| Product Name： | SOFALCONE |
| CAS： | 64506-49-6 |
| English Synonyms： | 2'-ETHOXYCARBONYLMETHOXY-4'-(3-METHYL-2-BUTENYL-OXY)ACETOPHENONE ; SOFALCONE |
| MDL Number.： | MFCD00868207 |
| H bond acceptor： | 6 |
| H bond donor： | 1 |
| Smile： | CC(=CCOc1ccc(cc1)/C=C/C(=O)c2ccc(cc2OCC(=O)O)OCC=C(C)C)C |
| InChi： | InChI=1S/C27H30O6/c1-19(2)13-15-31-22-8-5-21(6-9-22)7-12-25(28)24-11-10-23(32-16-14-20(3)4)17-26(24)33-18-27(29)30/h5-14,17H,15-16,18H2,1-4H3,(H,29,30)/b12-7+ |
| InChiKey： | InChIKey=GFWRVVCDTLRWPK-KPKJPENVSA-N |
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| Specification： | JP |
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Basic Information
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