Nh2-ala-leu-trp-met-thr-leu-leu-lys-lys-val-leu-lys-ala-ala-ala-lys-nh2

Structural Information

Molecular Formula

C₈₅H₁₅₀N₂₂O₁₇S

SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)O

InChI

InChI=1S/C85H150N22O17S/c1-45(2)39-63(101-71(110)50(11)90)81(120)103-67(43-55-44-92-57-28-18-17-27-56(55)57)83(122)100-62(33-38-125-16)78(117)107-69(54(15)108)85(124)105-66(42-48(7)8)82(121)102-64(40-46(3)4)79(118)99-60(31-21-25-36-88)76(115)97-61(32-22-26-37-89)77(116)106-68(49(9)10)84(123)104-65(41-47(5)6)80(119)98-59(30-20-24-35-87)75(114)95-52(13)73(112)93-51(12)72(111)94-53(14)74(113)96-58(70(91)109)29-19-23-34-86/h17-18,27-28,44-54,58-69,92,108H,19-26,29-43,86-90H2,1-16H3,(H2,91,109)(H,93,112)(H,94,111)(H,95,114)(H,96,113)(H,97,115)(H,98,119)(H,99,118)(H,100,122)(H,101,110)(H,102,121)(H,103,120)(H,104,123)(H,105,124)(H,106,116)(H,107,117)/t50-,51-,52-,53-,54+,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-/m0/s1

InChIKey

ZRBFYMSTHPRUEQ-PLFIIVLFSA-N

Compound name

(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]hexanamide

Related CIDs

• CID 6320908