Kkkkllaatyvlv

Structural Information

Molecular Formula

C₇₁H₁₂₇N₁₇O₁₆

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](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](CC(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/C71H127N17O16/c1-38(2)34-52(83-66(98)53(35-39(3)4)82-64(96)51(25-17-21-33-75)81-63(95)50(24-16-20-32-74)80-62(94)49(23-15-19-31-73)79-61(93)48(76)22-14-18-30-72)65(97)78-43(11)59(91)77-44(12)60(92)88-58(45(13)89)70(102)85-55(37-46-26-28-47(90)29-27-46)68(100)86-56(41(7)8)69(101)84-54(36-40(5)6)67(99)87-57(42(9)10)71(103)104/h26-29,38-45,48-58,89-90H,14-25,30-37,72-76H2,1-13H3,(H,77,91)(H,78,97)(H,79,93)(H,80,94)(H,81,95)(H,82,96)(H,83,98)(H,84,101)(H,85,102)(H,86,100)(H,87,99)(H,88,92)(H,103,104)/t43-,44-,45+,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-/m0/s1

InChIKey

DLVRPLKAXLUTPY-RVQXSPEVSA-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]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoic acid

Related CIDs

• CID 16073136