Kkkkvvaatyvfv

Structural Information

Molecular Formula

C₇₂H₁₂₁N₁₇O₁₆

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)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/C72H121N17O16/c1-39(2)55(87-70(102)57(41(5)6)85-65(97)52(28-18-22-36-76)82-64(96)51(27-17-21-35-75)81-63(95)50(26-16-20-34-74)80-62(94)49(77)25-15-19-33-73)68(100)79-43(9)60(92)78-44(10)61(93)89-59(45(11)90)71(103)84-54(38-47-29-31-48(91)32-30-47)66(98)86-56(40(3)4)69(101)83-53(37-46-23-13-12-14-24-46)67(99)88-58(42(7)8)72(104)105/h12-14,23-24,29-32,39-45,49-59,90-91H,15-22,25-28,33-38,73-77H2,1-11H3,(H,78,92)(H,79,100)(H,80,94)(H,81,95)(H,82,96)(H,83,101)(H,84,103)(H,85,97)(H,86,98)(H,87,102)(H,88,99)(H,89,93)(H,104,105)/t43-,44-,45+,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-/m0/s1

InChIKey

NORUHEKZGFGZER-CMKHGWEGSA-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]propanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoic acid

Related CIDs

• CID 16072969