Sqnypdvq

Structural Information

Molecular Formula

C₄₀H₅₉N₁₁O₁₆

SMILES

CC(C)[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CO)N

InChI

InChI=1S/C40H59N11O16/c1-18(2)32(38(64)46-23(40(66)67)10-12-29(43)55)50-36(62)25(16-31(57)58)48-37(63)27-4-3-13-51(27)39(65)26(14-19-5-7-20(53)8-6-19)49-35(61)24(15-30(44)56)47-34(60)22(9-11-28(42)54)45-33(59)21(41)17-52/h5-8,18,21-27,32,52-53H,3-4,9-17,41H2,1-2H3,(H2,42,54)(H2,43,55)(H2,44,56)(H,45,59)(H,46,64)(H,47,60)(H,48,63)(H,49,61)(H,50,62)(H,57,58)(H,66,67)/t21-,22-,23-,24-,25-,26-,27-,32-/m0/s1

InChIKey

RRCXKELNTZTVPV-DSUVSHDVSA-N

Compound name

(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-4-amino-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-carboxypropanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoic acid

Related CIDs

• CID 476707