Kaqvlaeams

Structural Information

Molecular Formula

C₄₄H₇₈N₁₂O₁₅S

SMILES

C[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCCCN)N

InChI

InChI=1S/C44H78N12O15S/c1-21(2)19-30(54-43(69)34(22(3)4)56-41(67)27(12-14-32(47)58)51-35(61)23(5)48-38(64)26(46)11-9-10-17-45)42(68)50-25(7)36(62)52-28(13-15-33(59)60)39(65)49-24(6)37(63)53-29(16-18-72-8)40(66)55-31(20-57)44(70)71/h21-31,34,57H,9-20,45-46H2,1-8H3,(H2,47,58)(H,48,64)(H,49,65)(H,50,68)(H,51,61)(H,52,62)(H,53,63)(H,54,69)(H,55,66)(H,56,67)(H,59,60)(H,70,71)/t23-,24-,25-,26-,27-,28-,29-,30-,31-,34-/m0/s1

InChIKey

GFMHAWJZDGSGFU-VPJQGJKXSA-N

Compound name

(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-5-[[(2S)-1-[[(2S)-1-[[(1S)-1-carboxy-2-hydroxyethyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

Related CIDs

• CID 5481542