Kkkkvvaatavlv

Structural Information

Molecular Formula

C₆₃H₁₁₉N₁₇O₁₅

SMILES

C[C@H]([C@@H](C(=O)N[C@@H](C)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](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/C63H119N17O15/c1-32(2)31-45(58(89)79-49(36(9)10)63(94)95)75-60(91)47(34(5)6)76-52(83)39(13)71-62(93)50(40(14)81)80-53(84)38(12)69-51(82)37(11)70-59(90)46(33(3)4)78-61(92)48(35(7)8)77-57(88)44(26-18-22-30-67)74-56(87)43(25-17-21-29-66)73-55(86)42(24-16-20-28-65)72-54(85)41(68)23-15-19-27-64/h32-50,81H,15-31,64-68H2,1-14H3,(H,69,82)(H,70,90)(H,71,93)(H,72,85)(H,73,86)(H,74,87)(H,75,91)(H,76,83)(H,77,88)(H,78,92)(H,79,89)(H,80,84)(H,94,95)/t37-,38-,39-,40+,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-/m0/s1

InChIKey

KXGCCFXVNGOVMN-GKGISVMRSA-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]propanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoic acid

Related CIDs

• CID 16073116