basic_info |
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Product_Name: | 8-DESACETYL-8-CARBOXY DAUNORUBICIN HYDROCHLORIDE |
CAS: | 58199-96-5 |
EnglishSynonyms: | (2S-CIS)-4-[(3-AMINO-2,3,6-TRIDEOXY-ALPHA-LYXO-HEXOPYRANOSYL)OXY]-1,2,3,4,6,11-HEXAHYDRO-2,5,12-TRIHYDROXY-7-METHOXY-6,11-DIOXO-2-NAPHTHACENE CARBOXYLIC ACID HYDROCHLORIDE ; 8-DESACETYL-8-CARBOXY DAUNORUBICIN HYDROCHLORIDE |
pro_mdlNumber: | MFCD09840341 |
pro_acceptors: | 12 |
pro_donors: | 6 |
pro_smile: | C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)O)O)N)O.Cl |
InChi: | InChI=1S/C26H27NO11.ClH/c1-9-20(28)12(27)6-15(37-9)38-14-8-26(35,25(33)34)7-11-17(14)24(32)19-18(22(11)30)21(29)10-4-3-5-13(36-2)16(10)23(19)31;/h3-5,9,12,14-15,20,28,30,32,35H,6-8,27H2,1-2H3,(H,33,34);1H/t9-,12-,14-,15-,20+,26-;/m0./s1 |
InChiKey: | InChIKey=HUXYGCZFLAONTF-BBIPQCLFSA-N |
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