Kkkkvlaatyflv

Structural Information

Molecular Formula

C₇₄H₁₂₅N₁₇O₁₆

SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC(C)C)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](CC(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/C74H125N17O16/c1-41(2)37-55(87-72(104)59(43(5)6)89-67(99)54(28-18-22-36-78)84-66(98)53(27-17-21-35-77)83-65(97)52(26-16-20-34-76)82-64(96)51(79)25-15-19-33-75)68(100)81-45(9)62(94)80-46(10)63(95)91-61(47(11)92)73(105)88-58(40-49-29-31-50(93)32-30-49)70(102)86-57(39-48-23-13-12-14-24-48)69(101)85-56(38-42(3)4)71(103)90-60(44(7)8)74(106)107/h12-14,23-24,29-32,41-47,51-61,92-93H,15-22,25-28,33-40,75-79H2,1-11H3,(H,80,94)(H,81,100)(H,82,96)(H,83,97)(H,84,98)(H,85,101)(H,86,102)(H,87,104)(H,88,105)(H,89,99)(H,90,103)(H,91,95)(H,106,107)/t45-,46-,47+,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-/m0/s1

InChIKey

CASYZILQBHUEQN-KJGCJDIXSA-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]-4-methylpentanoyl]amino]propanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoic acid

Related CIDs

• CID 16073146