CAT No: R2272
CAS No: 934461-40-2
Synonyms/Alias: UNII-T3B2AIZ4BF;934461-40-2;T3B2AIZ4BF;POT-4;(Trp(me)4)-ac-compstatin;4(1MeW);AL-78898A;L-Threoninamide, N-acetyl-L-isoleucyl-L-cysteinyl-L-valyl-1-methyl-L-tryptophyl-L-glutaminyl-L-alpha-aspartyl-L-tryptophylglycyl-L-alanyl-L-histidyl-L-arginyl-L-cysteinyl-, cyclic (2->12)-disulfide;DA-77009;L-Threoninamide, N-acetyl-L-isoleucyl-L-cysteinyl-L-valyl-1-methyl-L-tryptophyl-L-glutaminyl-L-alpha-aspartyl-L-tryptophylglycyl-L-alanyl-L-histidyl-L-arginyl-L-cysteinyl-, cyclic (2-->12)-disulfide;
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M.F/Formula | C72H102N22O18S2 |
M.W/Mr. | 1627.9 |
Sequence | One Letter Code:ICVXQDWGAHRCT Three Letter Code:Ac-Ile-Cys(1)-Val-Trp(Me)-Gln-Asp-Trp-Gly-Ala-His-Arg-Cys(1)-Thr-NH2 |
InChI | InChI=1S/C72H102N22O18S2/c1-9-35(4)58(83-38(7)96)71(112)91-52-32-114-113-31-51(69(110)93-59(37(6)95)60(74)101)90-63(104)45(18-14-22-78-72(75)76)84-66(107)49(25-41-28-77-33-81-41)86-61(102)36(5)82-55(98)29-80-62(103)47(23-39-27-79-44-17-12-10-15-42(39)44)87-67(108)50(26-56(99)100)88-64(105)46(20-21-54(73)97)85-65(106)48(89-70(111)57(34(2)3)92-68(52)109)24-40-30-94(8)53-19-13-11-16-43(40)53/h10-13,15-17,19,27-28,30,33-37,45-52,57-59,79,95H,9,14,18,20-26,29,31-32H2,1-8H3,(H2,73,97)(H2,74,101)(H,77,81)(H,80,103)(H,82,98)(H,83,96)(H,84,107)(H,85,106)(H,86,102)(H,87,108)(H,88,105)(H,89,111)(H,90,104)(H,91,112)(H,92,109)(H,93,110)(H,99,100)(H4,75,76,78)/t35-,36-,37+,45-,46-,47-,48-,49-,50-,51-,52-,57-,58-,59-/m0/s1 |
InChI Key | WMEMLXDTLKSUOD-OGCOPIPOSA-N |
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