7-EPI-CEPHALOMANNINE

pro_cas
pro_cdbregno
CCD00606950
pro_formula
C45 H53 N O14
pro_molWeight
831.907

basic_info

Product_Name: 7-EPI-CEPHALOMANNINE
EnglishSynonyms: 7-EPI-CEPHALOMANNINE ; CEPHALOMANNINE, 7-EPI-
pro_mdlNumber: MFCD07779153
pro_acceptors: 15
pro_donors: 4
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)OC(=O)C)C)OC(=O)c6ccccc6)O)O
InChi: InChI=1S/C45H53NO14/c1-9-23(2)39(52)46-33(27-16-12-10-13-17-27)34(50)41(54)58-29-21-45(55)38(59-40(53)28-18-14-11-15-19-28)36-43(8,30(49)20-31-44(36,22-56-31)60-26(5)48)37(51)35(57-25(4)47)32(24(29)3)42(45,6)7/h9-19,29-31,33-36,38,49-50,55H,20-22H2,1-8H3,(H,46,52)/b23-9+/t29-,30+,31+,33-,34+,35+,36-,38-,43+,44-,45+/m0/s1
InChiKey: InChIKey=DBXFAPJCZABTDR-DBVZQHIHSA-N

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