Basic Information |
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Product Name: | GE 2270 A |
CAS: | 134861-34-0 |
English Synonyms: | GE 2270 A |
MDL Number.: | MFCD00898053 |
H bond acceptor: | 25 |
H bond donor: | 7 |
Smile: | Cc1c2nc(s1)[C@@H](NC(=O)c3csc(n3)-c4ccc(nc4-c5csc(n5)-c6csc(n6)C(NC(=O)CNC(=O)c7c(sc(n7)[C@@H](NC2=O)C(C)C)COC)C(c8ccccc8)O)c9nc(cs9)C1=N[C@@H](CO1)C(=O)N1CCC[C@H]1C(=O)N)CC(=O)N |
InChi: | InChI=1S/C55H53N15O10S6/c1-23(2)38-54-69-41(35(86-54)18-79-4)46(76)58-16-37(72)66-42(43(73)25-9-6-5-7-10-25)53-65-33(22-84-53)51-62-30(19-82-51)40-26(49-63-31(20-81-49)45(75)60-28(15-36(56)71)52-68-39(24(3)85-52)47(77)67-38)12-13-27(59-40)50-64-32(21-83-50)48-61-29(17-80-48)55(78)70-14-8-11-34(70)44(57)74/h5-7,9-10,12-13,19-23,28-29,34,38,42-43,73H,8,11,14-18H2,1-4H3,(H2,56,71)(H2,57,74)(H,58,76)(H,60,75)(H,66,72)(H,67,77)/t28-,29-,34-,38-,42?,43?/m0/s1 |
InChiKey: | InChIKey=JMKLDKKRJNPACS-WYPXWMQZSA-N |
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