CAS 160927-63-9 | L-Alanine, L-asparaginyl-L-asparaginyl-L-glutaminyl-L-lysyl-L-isoleucyl-L-valyl-L-asparaginyl-L-leucyl-L-lysyl-L-α-glutamyl-L-lysyl-L-valyl-L-alanyl-L-glutaminyl-L-leucyl-L-α-glutamyl- | CAS Number 160927-63-9

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160927-63-9 | L-Alanine, L-asparaginyl-L-asparaginyl-L-glutaminyl-L-lysyl-L-isoleucyl-L-valyl-L-asparaginyl-L-leucyl-L-lysyl-L-α-glutamyl-L-lysyl-L-valyl-L-alanyl-L-glutaminyl-L-leucyl-L-α-glutamyl-

CAS No: 160927-63-9 Catalog No: AG001VHM MDL No:

Product Description

Catalog Number:

AG001VHM

Chemical Name:

L-Alanine, L-asparaginyl-L-asparaginyl-L-glutaminyl-L-lysyl-L-isoleucyl-L-valyl-L-asparaginyl-L-leucyl-L-lysyl-L-α-glutamyl-L-lysyl-L-valyl-L-alanyl-L-glutaminyl-L-leucyl-L-α-glutamyl-

CAS Number:

160927-63-9

Molecular Formula:

C84H147N25O27

Molecular Weight:

1939.2173

IUPAC Name:

(4S)-4-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-4-amino-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]-5-oxopentanoyl]amino]hexanoyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]amino]-5-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-4-carboxy-1-[[(1S)-1-carboxyethyl]amino]-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-oxopentanoic acid

InChI:

InChI=1S/C84H147N25O27/c1-13-43(10)67(109-76(127)49(22-16-19-33-87)98-72(123)51(24-28-59(90)111)101-79(130)56(37-61(92)113)103-69(120)46(88)36-60(91)112)83(134)108-66(42(8)9)82(133)106-57(38-62(93)114)80(131)105-55(35-40(4)5)77(128)99-47(20-14-17-31-85)71(122)100-53(26-30-64(117)118)73(124)97-48(21-15-18-32-86)75(126)107-65(41(6)7)81(132)94-44(11)68(119)96-50(23-27-58(89)110)74(125)104-54(34-39(2)3)78(129)102-52(25-29-63(115)116)70(121)95-45(12)84(135)136/h39-57,65-67H,13-38,85-88H2,1-12H3,(H2,89,110)(H2,90,111)(H2,91,112)(H2,92,113)(H2,93,114)(H,94,132)(H,95,121)(H,96,119)(H,97,124)(H,98,123)(H,99,128)(H,100,122)(H,101,130)(H,102,129)(H,103,120)(H,104,125)(H,105,131)(H,106,133)(H,107,126)(H,108,134)(H,109,127)(H,115,116)(H,117,118)(H,135,136)/t43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,65-,66-,67-/m0/s1

InChI Key:

CTXJCWOKDCJBQL-LQYIKSGDSA-N

SMILES:

NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC(=O)O)CC(C)C)CCC(=O)N)C)C(C)C)CCCCN)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)N)CC(=O)N)CCC(=O)N)CCCCN)CC(=O)N)CC(C)C