Kkkkvvlafyvlv

Structural Information

Molecular Formula

C₇₇H₁₃₁N₁₇O₁₅

SMILES

C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)N

InChI

InChI=1S/C77H131N17O15/c1-43(2)39-57(89-75(106)62(46(7)8)93-76(107)63(47(9)10)91-69(100)56(30-20-24-38-81)86-68(99)55(29-19-23-37-80)85-67(98)54(28-18-22-36-79)84-66(97)53(82)27-17-21-35-78)70(101)83-49(13)65(96)87-59(41-50-25-15-14-16-26-50)71(102)88-60(42-51-31-33-52(95)34-32-51)73(104)92-61(45(5)6)74(105)90-58(40-44(3)4)72(103)94-64(48(11)12)77(108)109/h14-16,25-26,31-34,43-49,53-64,95H,17-24,27-30,35-42,78-82H2,1-13H3,(H,83,101)(H,84,97)(H,85,98)(H,86,99)(H,87,96)(H,88,102)(H,89,106)(H,90,105)(H,91,100)(H,92,104)(H,93,107)(H,94,103)(H,108,109)/t49-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-/m0/s1

InChIKey

WTGBHMAYKFIVQE-NPLAHBGFSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoic acid

Related CIDs

• CID 16073019