Kkkkvvlatyvlf

Structural Information

Molecular Formula

C₇₆H₁₂₉N₁₇O₁₆

SMILES

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

InChI

InChI=1S/C76H129N17O16/c1-42(2)38-56(86-73(105)61(45(7)8)92-74(106)62(46(9)10)90-68(100)55(29-19-23-37-80)85-67(99)54(28-18-22-36-79)84-66(98)53(27-17-21-35-78)83-65(97)52(81)26-16-20-34-77)69(101)82-47(11)64(96)93-63(48(12)94)75(107)88-58(40-50-30-32-51(95)33-31-50)71(103)91-60(44(5)6)72(104)87-57(39-43(3)4)70(102)89-59(76(108)109)41-49-24-14-13-15-25-49/h13-15,24-25,30-33,42-48,52-63,94-95H,16-23,26-29,34-41,77-81H2,1-12H3,(H,82,101)(H,83,97)(H,84,98)(H,85,99)(H,86,105)(H,87,104)(H,88,107)(H,89,102)(H,90,100)(H,91,103)(H,92,106)(H,93,96)(H,108,109)/t47-,48+,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-/m0/s1

InChIKey

RGXYOJBIRKQZEB-QQFLAGQBSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-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-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid

Related CIDs

• CID 16073020