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Molecular Formula: C42H60BrN24O12-
Molecular weight: 1172.9834
InChi: InChI=1S/C42H60N24O12.BrH/c1-43-19-20(44(2)31(43)67)56-14-58-23-24(48(6)33(69)47(23)5)60(39(58)75)16-62-27-28(52(10)35(71)51(27)9)64(41(62)77)18-66-30-29(53(11)36(72)54(30)12)65(42(66)78)17-63-26-25(49(7)34(70)50(26)8)61(40(63)76)15-59-22-21(45(3)32(68)46(22)4)57(38(59)74)13-55(19)37(56)73;/h19-30H,13-18H2,1-12H3;1H/p-1/t19-,20+,21+,22-,23-,24+,25+,26-,27-,28+,29+,30-;
InChi Key: GSKDETUPRDTGJN-CYTVWBSZSA-M
SMILES: [Br-].[C@H]12[C@H](N3C(=O)N1CN1[C@H]4[C@@H](N(C1=O)CN1[C@H]5[C@@H](N(C1=O)CN1[C@H]6[C@@H](N(CN7C(=O)N(CN8C(=O)N(C3)[C@@H]3[C@H]8N(C(=O)N3C)C)[C@@H]3[C@H]7N(C(=O)N3C)C)C1=O)N(C(=O)N6C)C)N(C(=O)N5C)C)N(C(=O)N4C)C)N(C(=O)N2C)C
Chemical Name
dodecamethylbambus[6]uril-bromide complex
External Links
PubChem