Nh2-glu-ser-leu-ala-leu-tyr-lys-ser-leu-gln-gln-ser-glu-met-leu-leu-glu-leu-glu-leu-cooh

Structural Information

Molecular Formula

C₁₀₄H₁₇₃N₂₃O₃₅S

SMILES

C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)N

InChI

InChI=1S/C104H173N23O35S/c1-50(2)39-68(121-102(159)76(47-128)125-86(143)60(106)24-32-81(134)135)94(151)109-57(15)85(142)117-69(40-51(3)4)98(155)123-74(46-58-20-22-59(131)23-21-58)100(157)110-61(19-17-18-37-105)87(144)126-78(49-130)103(160)122-72(43-54(9)10)97(154)112-62(25-30-79(107)132)88(145)111-63(26-31-80(108)133)92(149)127-77(48-129)101(158)115-64(27-33-82(136)137)89(146)116-67(36-38-163-16)93(150)119-73(44-55(11)12)99(156)120-71(42-53(7)8)96(153)113-65(28-34-83(138)139)90(147)118-70(41-52(5)6)95(152)114-66(29-35-84(140)141)91(148)124-75(104(161)162)45-56(13)14/h20-23,50-57,60-78,128-131H,17-19,24-49,105-106H2,1-16H3,(H2,107,132)(H2,108,133)(H,109,151)(H,110,157)(H,111,145)(H,112,154)(H,113,153)(H,114,152)(H,115,158)(H,116,146)(H,117,142)(H,118,147)(H,119,150)(H,120,156)(H,121,159)(H,122,160)(H,123,155)(H,124,148)(H,125,143)(H,126,144)(H,127,149)(H,134,135)(H,136,137)(H,138,139)(H,140,141)(H,161,162)/t57-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-/m0/s1

InChIKey

LHWMRRDUFLAYCP-KGXUEFGQSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-carboxybutanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-3-hydroxypropanoyl]amino]-4-carboxybutanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoic acid

Related CIDs

• CID 16138698