Kkkkvvaatyvfva

Structural Information

Molecular Formula

C₇₅H₁₂₆N₁₈O₁₇

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](CC2=CC=CC=C2)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](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/C75H126N18O17/c1-40(2)57(71(105)83-46(11)75(109)110)90-68(102)55(38-48-24-14-13-15-25-48)87-72(106)59(42(5)6)91-69(103)56(39-49-30-32-50(95)33-31-49)88-74(108)61(47(12)94)93-63(97)45(10)81-62(96)44(9)82-70(104)58(41(3)4)92-73(107)60(43(7)8)89-67(101)54(29-19-23-37-79)86-66(100)53(28-18-22-36-78)85-65(99)52(27-17-21-35-77)84-64(98)51(80)26-16-20-34-76/h13-15,24-25,30-33,40-47,51-61,94-95H,16-23,26-29,34-39,76-80H2,1-12H3,(H,81,96)(H,82,104)(H,83,105)(H,84,98)(H,85,99)(H,86,100)(H,87,106)(H,88,108)(H,89,101)(H,90,102)(H,91,103)(H,92,107)(H,93,97)(H,109,110)/t44-,45-,46-,47+,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-/m0/s1

InChIKey

OGKCIJCYIHRDHV-CWYXQFISSA-N

Compound name

(2S)-2-[[(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]propanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoyl]amino]propanoic acid

Related CIDs

• CID 16072949