NEOCOPIAMYCIN A

pro_cas
89989-28-6
pro_cdbregno
CCD00274042
pro_formula
C53 H93 N3 O17
pro_molWeight
1044.32

basic_info

Product_Name: NEOCOPIAMYCIN A
CAS: 89989-28-6
EnglishSynonyms: NEOCOPIAMYCIN A
pro_mdlNumber: MFCD01939511
pro_acceptors: 20
pro_donors: 14
pro_smile: CC1CCC(C(C(CC(C(/C=C/C(=O)OC(C(/C=C/C(C(C(CC(CC(CC2CC(C(C(O2)(CC1O)O)O)O)OC(=O)CC(=O)O)O)O)C)O)C)C(C)CC(C)CCC/C=C/CCCNC(=N)N)C)O)O)C)O
InChi: InChI=1S/C53H93N3O17/c1-30(14-12-10-8-9-11-13-21-56-52(54)55)22-34(5)50-33(4)16-19-41(59)35(6)43(61)24-37(57)23-38(71-49(68)28-47(65)66)25-39-26-45(63)51(69)53(70,73-39)29-46(64)32(3)15-18-40(58)36(7)44(62)27-42(60)31(2)17-20-48(67)72-50/h8-9,16-17,19-20,30-46,50-51,57-64,69-70H,10-15,18,21-29H2,1-7H3,(H,65,66)(H4,54,55,56)/b9-8+,19-16+,20-17+
InChiKey: InChIKey=GZWCSBWYVZFWGF-HLARTDLKSA-N

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