H-ala-glu-ala-met-ala-gln-val-thr-asn-oh

Structural Information

Molecular Formula

C₃₇H₆₃N₁₁O₁₅S

SMILES

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

InChI

InChI=1S/C37H63N11O15S/c1-15(2)27(35(60)48-28(19(6)49)36(61)46-23(37(62)63)14-25(40)51)47-34(59)20(8-10-24(39)50)44-30(55)17(4)42-33(58)22(12-13-64-7)45-31(56)18(5)41-32(57)21(9-11-26(52)53)43-29(54)16(3)38/h15-23,27-28,49H,8-14,38H2,1-7H3,(H2,39,50)(H2,40,51)(H,41,57)(H,42,58)(H,43,54)(H,44,55)(H,45,56)(H,46,61)(H,47,59)(H,48,60)(H,52,53)(H,62,63)/t16-,17-,18-,19+,20-,21-,22-,23-,27-,28-/m0/s1

InChIKey

RMDOFIIABLGQNZ-PCFFGQLRSA-N

Compound name

(4S)-5-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S,3R)-1-[[(1S)-3-amino-1-carboxy-3-oxopropyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-[[(2S)-2-aminopropanoyl]amino]-5-oxopentanoic acid

Related CIDs

• CID 5482405