Kkkkvvaatpvlv

Structural Information

Molecular Formula

C₆₅H₁₂₁N₁₇O₁₅

SMILES

C[C@H]([C@@H](C(=O)N1CCC[C@H]1C(=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/C65H121N17O15/c1-34(2)33-46(59(90)80-51(38(9)10)65(96)97)76-62(93)49(36(5)6)78-60(91)47-27-22-32-82(47)64(95)52(41(13)83)81-54(85)40(12)71-53(84)39(11)72-61(92)48(35(3)4)79-63(94)50(37(7)8)77-58(89)45(26-17-21-31-69)75-57(88)44(25-16-20-30-68)74-56(87)43(24-15-19-29-67)73-55(86)42(70)23-14-18-28-66/h34-52,83H,14-33,66-70H2,1-13H3,(H,71,84)(H,72,92)(H,73,86)(H,74,87)(H,75,88)(H,76,93)(H,77,89)(H,78,91)(H,79,94)(H,80,90)(H,81,85)(H,96,97)/t39-,40-,41+,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-/m0/s1

InChIKey

GLEQIBHJOPCNAL-UNDCPQNASA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(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]pyrrolidine-2-carbonyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoic acid

Related CIDs

• CID 16073010