Chembl213959

Structural Information

Molecular Formula

C₃₃H₅₄N₁₀O₁₅

SMILES

C[C@H]([C@@H](C(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)CNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)O

InChI

InChI=1S/C33H54N10O15/c1-14(38-29(54)17-5-4-12-36-17)28(53)40-19(7-10-23(48)49)32(57)43-26(16(3)45)33(58)37-13-22(47)39-18(6-9-21(34)46)30(55)41-20(8-11-24(50)51)31(56)42-25(15(2)44)27(35)52/h14-20,25-26,36,44-45H,4-13H2,1-3H3,(H2,34,46)(H2,35,52)(H,37,58)(H,38,54)(H,39,47)(H,40,53)(H,41,55)(H,42,56)(H,43,57)(H,48,49)(H,50,51)/t14-,15+,16+,17-,18-,19-,20-,25-,26-/m0/s1

InChIKey

IUCRHEWAABFKND-SEOSWDOBSA-N

Compound name

(4S)-5-[[(2S,3R)-1-[[2-[[(2S)-5-amino-1-[[(2S)-1-[[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-5-oxo-4-[[(2S)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]pentanoic acid

Related CIDs

• CID 11846953