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4-azanyl-5-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-(carboxymethylamino)-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-5

Systemtic Name:	4-azanyl-5-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-(carboxymethylamino)-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-5
Openeye Name:	4-amino-5-[[1-[[1-[[2-[[1-[[2-[[2-[[2-[[2-[[1-[[1-(carboxymethylcarbamoyl)-2-methyl-butyl]carbamoyl]-3-methylsulfanyl-propyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]amino]-2-oxo-1-(sulfanylmethyl)ethyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]carbamoyl]-4-hydroxy-4-oxo-butyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]carbamoyl]-4-hydroxy-4-oxo-butyl]amino]-5-oxo-pentanoic acid
CAS Name:	4-amino-5-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-(carboxymethylamino)-3-methyl-1-oxopentan-2-yl]amino]-4-(methylthio)-1-oxobutan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-mercapto-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-yl]amino]-5-oxopentanoic acid
IUPAC Name:	4-amino-5-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-[[1-(carboxymethylamino)-3-methyl-1-oxopentan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-yl]amino]-5-oxopentanoic acid
Traditional Name:	4-amino-5-[[1-[[1-[[2-[[1-[[2-[[2-[[2-[[2-[[1-[[1-(carboxymethylcarbamoyl)-2-methyl-butyl]carbamoyl]-3-(methylthio)propyl]amino]-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]amino]-2-keto-1-methylol-ethyl]amino]-2-keto-1-(mercaptomethyl)ethyl]amino]-1-(4-hydroxybenzyl)-2-keto-ethyl]carbamoyl]-4-hydroxy-4-keto-butyl]amino]-2-keto-1-methylol-ethyl]carbamoyl]-2-methyl-propyl]carbamoyl]-4-hydroxy-4-keto-butyl]amino]-5-keto-valeric acid
Formula:	C₅₇H₈₆N₁₄O₂₂S₂
MolecularWeight:	1383.50334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC(=O)O)NC(=O)C(CCSC)NC(=O)C(CC1=CN=CN1)NC(=O)C(CO)NC(=O)C(CS)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CCC(=O)O)NC(=O)C(CO)NC(=O)C(C(C)C)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

CCC(C)C(C(=O)NCC(=O)O)NC(=O)C(CCSC)NC(=O)C(CC1=CN=CN1)NC(=O)C(CO)NC(=O)C(CS)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CCC(=O)O)NC(=O)C(CO)NC(=O)C(C(C)C)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)N

InChI

InChI=1S/C57H86N14O22S2/c1-6-28(4)46(56(92)60-22-44(81)82)71-50(86)35(17-18-95-5)64-52(88)37(20-30-21-59-26-61-30)66-54(90)38(23-72)67-55(91)40(25-94)69-51(87)36(19-29-7-9-31(74)10-8-29)65-48(84)33(12-15-42(77)78)63-53(89)39(24-73)68-57(93)45(27(2)3)70-49(85)34(13-16-43(79)80)62-47(83)32(58)11-14-41(75)76/h7-10,21,26-28,32-40,45-46,72-74,94H,6,11-20,22-25,58H2,1-5H3,(H,59,61)(H,60,92)(H,62,83)(H,63,89)(H,64,88)(H,65,84)(H,66,90)(H,67,91)(H,68,93)(H,69,87)(H,70,85)(H,71,86)(H,75,76)(H,77,78)(H,79,80)(H,81,82)

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