N²-Acetyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-N-[(4S,7R,10S)-4-{[(2R)-1-{[(2R)-1-{[(2R)-6-amino-1-{[(1R)-3-amino-1-carboxy-3-oxopropyl]amino}-1-oxo-2-hexa nyl]amino}-5-carbamimidamido-1-oxo-2-pentanyl]amino}-5-carbamimidamido-1-oxo-2-pentanyl]carbamoyl}-7-(3-amino-3-oxopropyl)-6,9-dioxo-1,2-dithia-5,8-diazacycloundecan-10-yl]-D-argininamide

More details:

• Systematic name

  N~2~-Acetyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-D-arginyl-N-[(4S,7R,10S)-4-{[(2R)-1-{[(2R)-1-{[(2R)-6-amino-1-{[(1R)-3-amino-1-carboxy-3-oxopropyl]amino}-1-oxo-2-hexa nyl]amino}-5-carbamimidamido-1-oxo-2-pentanyl]amino}-5-carbamimidamido-1-oxo-2-pentanyl]carbamoyl}-7-(3-amino-3-oxopropyl)-6,9-dioxo-1,2-dithia-5,8-diazacycloundecan-10-yl]-D-argininamide

• SMILES

  CC(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@@H](CCC(N)=O)NC1=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CC(N)=O)C(O)=O

• Std. InChi

  InChI=1S/C89H170N52O20S2/c1-44(142)126-45(16-4-30-115-79(93)94)63(145)128-47(17-5-31-116-80(95)96)65(147)129-49(19-7-33-118-82(99)100)66(148)130-50(20-8-34-119-83(101)102)67(149)131-51(21-9-35-120-84(103)104)68(150)132-52(22-10-36-121-85(105)106)69(151)133-53(23-11-37-122-86(107)108)70(152)134-54(24-12-38-123-87(109)110)71(153)136-56(26-14-40-125-89(113)114)74(156)140-60-43-163-162-42-59(141-75(157)57(138-77(60)159)27-28-61(91)143)76(158)137-55(25-13-39-124-88(111)112)72(154)135-48(18-6-32-117-81(97)98)64(146)127-46(15-2-3-29-90)73(155)139-58(78(160)161)41-62(92)144/h45-60H,2-43,90H2,1H3,(H2,91,143)(H2,92,144)(H,126,142)(H,127,146)(H,128,145)(H,129,147)(H,130,148)(H,131,149)(H,132,150)(H,133,151)(H,134,152)(H,135,154)(H,136,153)(H,137,158)(H,138,159)(H,139,155)(H,140,156)(H,141,157)(H,160,161)(H4,93,94,115)(H4,95,96,116)(H4,97,98,117)(H4,99,100,118)(H4,101,102,119)(H4,103,104,120)(H4,105,106,121)(H4,107,108,122)(H4,109,110,123)(H4,111,112,124)(H4,113,114,125)/t45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-/m1/s1

• Std. InChIKey

  MDQMFOHHSFMREL-YIYMUJAPSA-N

• Cite this record

  CSID:81367733, http://www.chemspider.com/Chemical-Structure.81367733.html (accessed 15:06, May 21, 2024)