Sqnypavq

Structural Information

Molecular Formula

C₃₉H₅₉N₁₁O₁₄

SMILES

C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)N)C(=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/C39H59N11O14/c1-18(2)31(37(61)46-24(39(63)64)11-13-29(42)54)49-32(56)19(3)44-36(60)27-5-4-14-50(27)38(62)26(15-20-6-8-21(52)9-7-20)48-35(59)25(16-30(43)55)47-34(58)23(10-12-28(41)53)45-33(57)22(40)17-51/h6-9,18-19,22-27,31,51-52H,4-5,10-17,40H2,1-3H3,(H2,41,53)(H2,42,54)(H2,43,55)(H,44,60)(H,45,57)(H,46,61)(H,47,58)(H,48,59)(H,49,56)(H,63,64)/t19-,22-,23-,24-,25-,26-,27-,31-/m0/s1

InChIKey

SZQDFMXOVAHMGX-OMAAEHQLSA-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]propanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoic acid

Related CIDs

• CID 5481570