Basic Information |
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Product Name: | ANGELICAIN |
CAS: | 49624-66-0 ;64519-22-8 |
English Synonyms: | ANGELICAIN ; NORCIMIFUGIN |
MDL Number.: | MFCD09264642 |
H bond acceptor: | 6 |
H bond donor: | 3 |
Smile: | CC(C)([C@@H]1Cc2c(cc3c(c2O)c(=O)cc(o3)CO)O1)O |
InChi: | InChI=1S/C15H16O6/c1-15(2,19)12-4-8-10(21-12)5-11-13(14(8)18)9(17)3-7(6-16)20-11/h3,5,12,16,18-19H,4,6H2,1-2H3/t12-/m0/s1 |
InChiKey: | InChIKey=FHCHSXPHLRBEBR-LBPRGKRZSA-N |
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