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4-[2-[[1-(2-azanylethanoyl)pyrrolidin-2-yl]carbonylamino]propanoylamino]-5-oxidanylidene-5-[[2-oxidanylidene-2-[2-[[1-oxidanylidene-1-[[5-oxidanyl-1-[2-[[1-[[1-[[5-oxidanyl-1,5-bis(oxidanylidene)-1-[[1-oxidanylidene-1-[[3-oxidanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]propan-2-yl]amino]propan-2-yl]amino]pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]carbamoyl]pyrrolidin-1-yl]-1,5-bis(oxidanylidene)pentan-2-yl]amino]propan-2-yl]carbamoy

Systemtic Name:	4-[2-[[1-(2-azanylethanoyl)pyrrolidin-2-yl]carbonylamino]propanoylamino]-5-oxidanylidene-5-[[2-oxidanylidene-2-[2-[[1-oxidanylidene-1-[[5-oxidanyl-1-[2-[[1-[[1-[[5-oxidanyl-1,5-bis(oxidanylidene)-1-[[1-oxidanylidene-1-[[3-oxidanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]propan-2-yl]amino]propan-2-yl]amino]pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]carbamoyl]pyrrolidin-1-yl]-1,5-bis(oxidanylidene)pentan-2-yl]amino]propan-2-yl]carbamoy
Openeye Name:	4-[2-[[1-(2-aminoacetyl)pyrrolidine-2-carbonyl]amino]propanoylamino]-5-[[2-[2-[[2-[[4-hydroxy-1-[2-[[2-[[2-[[4-hydroxy-1-[[2-[[1-(hydroxymethyl)-2-[[2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]amino]-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]pyrrolidine-1-carbonyl]-4-oxo-butyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
CAS Name:	4-[[2-[[[1-(2-amino-1-oxoethyl)-2-pyrrolidinyl]-oxomethyl]amino]-1-oxopropyl]amino]-5-[[2-[2-[[[1-[[5-hydroxy-1-[2-[[[1-[[1-[[5-hydroxy-1-[[1-[[3-hydroxy-1-[(1-hydroxy-3-mercapto-1-oxopropan-2-yl)amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-2-oxoethyl]amino]-5-oxopentanoic acid
IUPAC Name:	4-[2-[[1-(2-aminoacetyl)pyrrolidine-2-carbonyl]amino]propanoylamino]-5-[[2-[2-[[1-[[5-hydroxy-1-[2-[[1-[[1-[[5-hydroxy-1-[[1-[[3-hydroxy-1-[(1-hydroxy-1-oxo-3-sulfanylpropan-2-yl)amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-2-oxoethyl]amino]-5-oxopentanoic acid
Traditional Name:	4-[2-[(1-glycylprolyl)amino]propanoylamino]-5-[[2-[2-[[2-[[4-hydroxy-1-[2-[[2-[[2-[[4-hydroxy-1-[[2-[[2-[[2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]amino]-2-keto-1-methylol-ethyl]amino]-2-keto-1-methyl-ethyl]carbamoyl]-4-keto-butyl]amino]-2-keto-1-methyl-ethyl]amino]-2-keto-1-methyl-ethyl]carbamoyl]pyrrolidine-1-carbonyl]-4-keto-butyl]amino]-2-keto-1-methyl-ethyl]carbamoyl]pyrrolidino]-2-keto-ethyl]amino]-5-keto-valeric acid
Formula:	C₅₅H₈₅N₁₅O₂₃S
MolecularWeight:	1356.4151

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)C(=O)NC(CCC(=O)O)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(CS)C(=O)O)NC(=O)C1CCCN1C(=O)C(CCC(=O)O)NC(=O)C(C)NC(=O)C2CCCN2C(=O)CNC(=O)C(CCC(=O)O)NC(=O)C(C)NC(=O)C3CCCN3C(=O)CN

Isomeric SMILES

CC(C(=O)NC(C)C(=O)NC(CCC(=O)O)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(CS)C(=O)O)NC(=O)C1CCCN1C(=O)C(CCC(=O)O)NC(=O)C(C)NC(=O)C2CCCN2C(=O)CNC(=O)C(CCC(=O)O)NC(=O)C(C)NC(=O)C3CCCN3C(=O)CN

InChI

InChI=1S/C55H85N15O23S/c1-25(43(80)58-26(2)44(81)64-31(13-16-41(76)77)49(86)59-27(3)47(84)66-33(23-71)50(87)67-34(24-94)55(92)93)60-53(90)37-11-8-20-70(37)54(91)32(14-17-42(78)79)65-46(83)29(5)62-52(89)36-10-7-19-69(36)39(73)22-57-48(85)30(12-15-40(74)75)63-45(82)28(4)61-51(88)35-9-6-18-68(35)38(72)21-56/h25-37,71,94H,6-24,56H2,1-5H3,(H,57,85)(H,58,80)(H,59,86)(H,60,90)(H,61,88)(H,62,89)(H,63,82)(H,64,81)(H,65,83)(H,66,84)(H,67,87)(H,74,75)(H,76,77)(H,78,79)(H,92,93)

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