7-EPI-10-DEACETYL CEPHALOMANNINE

pro_cas
pro_cdbregno
CCD01997762
pro_formula
C43 H51 N O13
pro_molWeight
789.87

basic_info

Product_Name: 7-EPI-10-DEACETYL CEPHALOMANNINE
EnglishSynonyms: 7-EPI-10-DEACETYL CEPHALOMANNINE
pro_mdlNumber: MFCD13182333
pro_acceptors: 14
pro_donors: 5
pro_smile: C/C=C(\C)/C(=O)N[C@@H](c1ccccc1)[C@H](C(=O)O[C@H]2C[C@]3([C@H]([C@H]4[C@@]([C@@H](C[C@@H]5[C@]4(CO5)OC(=O)C)O)(C(=O)[C@@H](C(=C2C)C3(C)C)O)C)OC(=O)c6ccccc6)O)O
InChi: InChI=1S/C43H51NO13/c1-8-22(2)37(50)44-31(25-15-11-9-12-16-25)33(48)39(52)55-27-20-43(53)36(56-38(51)26-17-13-10-14-18-26)34-41(7,35(49)32(47)30(23(27)3)40(43,5)6)28(46)19-29-42(34,21-54-29)57-24(4)45/h8-18,27-29,31-34,36,46-48,53H,19-21H2,1-7H3,(H,44,50)/b22-8+/t27-,28+,29+,31-,32+,33+,34-,36-,41+,42-,43+/m0/s1
InChiKey: InChIKey=ADDGUHVEJPNWQZ-WLNUZSSLSA-N

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