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(4S)-5-[[(2S)-6-azanyl-1-[[(2S,3R)-1-[[(2S)-6-azanyl-1-[[(2S)-1-[[(2S)-1-[[(2S)-3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanyl-3-methyl-butanoyl]amino]-3-phenyl-propanoyl]amino]propanoyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name:	(4S)-5-[[(2S)-6-azanyl-1-[[(2S,3R)-1-[[(2S)-6-azanyl-1-[[(2S)-1-[[(2S)-1-[[(2S)-3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanyl-3-methyl-butanoyl]amino]-3-phenyl-propanoyl]amino]propanoyl]amino]-5-oxidanylidene-pentanoic acid
Openeye Name:	(4S)-5-[[(1S)-5-amino-1-[[(1S,2R)-1-[[(1S)-5-amino-1-[[(1S)-2-[[(1S)-4-hydroxy-1-[[(1S)-2-hydroxy-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]pentyl]carbamoyl]-2-hydroxy-propyl]carbamoyl]pentyl]amino]-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methyl-butanoyl]amino]-3-phenyl-propanoyl]amino]propanoyl]amino]-5-oxo-pentanoic acid
CAS Name:	(4S)-5-[[(2S)-6-amino-1-[[(2S,3R)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-5-hydroxy-1-[[(2S)-1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methyl-1-oxobutyl]amino]-1-oxo-3-phenylpropyl]amino]-1-oxopropyl]amino]-5-oxopentanoic acid
IUPAC Name:	(4S)-5-[[(2S)-6-amino-1-[[(2S,3R)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-5-hydroxy-1-[[(2S)-1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]propanoyl]amino]-5-oxopentanoic acid
Traditional Name:	(4S)-5-[[(1S)-5-amino-1-[[(1S,2R)-1-[[(1S)-5-amino-1-[[(1S)-2-[[(1S)-4-hydroxy-1-[[(1S)-2-hydroxy-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamoyl]-4-keto-butyl]amino]-2-keto-1-methyl-ethyl]carbamoyl]pentyl]carbamoyl]-2-hydroxy-propyl]carbamoyl]pentyl]amino]-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methyl-butanoyl]amino]-3-phenyl-propanoyl]amino]propanoyl]amino]-5-keto-valeric acid
Formula:	C₅₇H₈₅N₁₃O₁₆
MolecularWeight:	1208.3623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(=O)NC(CCCCN)C(=O)NC(C(C)O)C(=O)NC(CCCCN)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O)N

Isomeric SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](C(C)C)N)O

InChI

InChI=1S/C57H85N13O16/c1-30(2)46(60)55(83)68-42(27-34-15-7-6-8-16-34)54(82)63-32(4)49(77)64-40(21-23-44(72)73)51(79)66-39(20-12-14-26-59)53(81)70-47(33(5)71)56(84)67-38(19-11-13-25-58)50(78)62-31(3)48(76)65-41(22-24-45(74)75)52(80)69-43(57(85)86)28-35-29-61-37-18-10-9-17-36(35)37/h6-10,15-18,29-33,38-43,46-47,61,71H,11-14,19-28,58-60H2,1-5H3,(H,62,78)(H,63,82)(H,64,77)(H,65,76)(H,66,79)(H,67,84)(H,68,83)(H,69,80)(H,70,81)(H,72,73)(H,74,75)(H,85,86)/t31-,32-,33+,38-,39-,40-,41-,42-,43-,46-,47-/m0/s1

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