Basic Information |
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Product Name: | CASPASE 2 SUBSTRATE 2, FLUOROGENIC |
English Synonyms: | ICH-1 SUBSTRATE 2, FLUOROGENIC ; CASPASE-2 SUBSTRATE II, FLUOROGENIC ; MCA-VAL-ASP-VAL-ALA-ASP-GLY-TRP-LYS(DNP)-NH2 ; CASPASE 2 SUBSTRATE 2, FLUOROGENIC ; MCA-VDVADGWK(DNP)-NH2 |
MDL Number.: | MFCD08459389 |
H bond acceptor: | 33 |
H bond donor: | 13 |
Smile: | CC(C)[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CCCCNc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-])C(=O)N)NC(=O)Cc4cc(=O)oc5c4ccc(c5)OC |
InChi: | InChI=1S/C58H71N13O20/c1-28(2)50(68-45(72)20-31-21-49(78)91-44-23-34(90-6)15-16-36(31)44)58(85)67-42(25-48(76)77)56(83)69-51(29(3)4)57(84)63-30(5)53(80)66-41(24-47(74)75)54(81)62-27-46(73)64-40(19-32-26-61-37-12-8-7-11-35(32)37)55(82)65-39(52(59)79)13-9-10-18-60-38-17-14-33(70(86)87)22-43(38)71(88)89/h7-8,11-12,14-17,21-23,26,28-30,39-42,50-51,60-61H,9-10,13,18-20,24-25,27H2,1-6H3,(H2,59,79)(H,62,81)(H,63,84)(H,64,73)(H,65,82)(H,66,80)(H,67,85)(H,68,72)(H,69,83)(H,74,75)(H,76,77)/t30-,39-,40-,41-,42-,50-,51-/m0/s1 |
InChiKey: | InChIKey=QMDSMMNSJSTLTL-BXIRZCRHSA-N |
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