Gicrcicgrgicrcycgr

Structural Information

Molecular Formula

C₇₇H₁₃₄N₃₀O₂₀S₆

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)CN

InChI

InChI=1S/C77H134N30O20S6/c1-7-37(4)57(105-53(109)27-78)70(123)103-50(34-131)66(119)97-44(16-12-24-89-76(83)84)64(117)101-52(36-133)69(122)107-59(39(6)9-3)72(125)102-48(32-129)62(115)92-28-54(110)94-42(14-10-22-87-74(79)80)60(113)91-30-56(112)106-58(38(5)8-2)71(124)104-51(35-132)67(120)96-43(15-11-23-88-75(81)82)63(116)100-49(33-130)68(121)98-46(26-40-18-20-41(108)21-19-40)65(118)99-47(31-128)61(114)93-29-55(111)95-45(73(126)127)17-13-25-90-77(85)86/h18-21,37-39,42-52,57-59,108,128-133H,7-17,22-36,78H2,1-6H3,(H,91,113)(H,92,115)(H,93,114)(H,94,110)(H,95,111)(H,96,120)(H,97,119)(H,98,121)(H,99,118)(H,100,116)(H,101,117)(H,102,125)(H,103,123)(H,104,124)(H,105,109)(H,106,112)(H,107,122)(H,126,127)(H4,79,80,87)(H4,81,82,88)(H4,83,84,89)(H4,85,86,90)/t37-,38-,39-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,57-,58-,59-/m0/s1

InChIKey

SVYFVASNXCEPNK-JICLIJSGSA-N

Compound name

(2S)-2-[[2-[[(2R)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-[[(2S,3S)-2-[[2-[[(2S)-2-[[2-[[(2R)-2-[[(2S,3S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-[[(2S,3S)-2-[(2-aminoacetyl)amino]-3-methylpentanoyl]amino]-3-sulfanylpropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-sulfanylpropanoyl]amino]-3-methylpentanoyl]amino]-3-sulfanylpropanoyl]amino]acetyl]amino]-5-carbamimidamidopentanoyl]amino]acetyl]amino]-3-methylpentanoyl]amino]-3-sulfanylpropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-sulfanylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-sulfanylpropanoyl]amino]acetyl]amino]-5-carbamimidamidopentanoic acid

Related CIDs

• CID 16133593