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methyl (2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-azanyl-2-[4-[7-[4-[[(2S)-5-azanyl-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-1,5-bis(oxidanylidene)pentan-2-yl]amino]-4-oxidanylidene-butoxy]naphthalen-2-yl]oxybutanoylamino]-5-oxidanylidene-pentanoyl]amino]-3-methyl-pentanoyl]amino]-3-oxidanyl-butanoyl]amino]-4-methyl-pentanoate

Systemtic Name:	methyl (2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-azanyl-2-[4-[7-[4-[[(2S)-5-azanyl-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-1,5-bis(oxidanylidene)pentan-2-yl]amino]-4-oxidanylidene-butoxy]naphthalen-2-yl]oxybutanoylamino]-5-oxidanylidene-pentanoyl]amino]-3-methyl-pentanoyl]amino]-3-oxidanyl-butanoyl]amino]-4-methyl-pentanoate
Openeye Name:	methyl (2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[4-[[7-[4-[[(1S)-4-amino-1-[[(1S,2S)-1-[[(1S)-2-hydroxy-1-[[(1S)-1-methoxycarbonyl-3-methyl-butyl]carbamoyl]propyl]carbamoyl]-2-methyl-butyl]carbamoyl]-4-oxo-butyl]amino]-4-oxo-butoxy]-2-naphthyl]oxy]butanoylamino]-5-oxo-pentanoyl]amino]-3-methyl-pentanoyl]amino]-3-hydroxy-butanoyl]amino]-4-methyl-pentanoate
CAS Name:	(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[4-[[7-[4-[[(2S)-5-amino-1-[[(2S,3S)-1-[[(2S)-3-hydroxy-1-[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-4-oxobutoxy]-2-naphthalenyl]oxy]-1-oxobutyl]amino]-1,5-dioxopentyl]amino]-3-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxobutyl]amino]-4-methylpentanoic acid methyl ester
IUPAC Name:	methyl (2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[4-[7-[4-[[(2S)-5-amino-1-[[(2S,3S)-1-[[(2S)-3-hydroxy-1-[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-4-oxobutoxy]naphthalen-2-yl]oxybutanoylamino]-5-oxopentanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoate
Traditional Name:	(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[4-[7-[4-[[(1S)-4-amino-1-[[(1S,2S)-1-[[(1S)-1-[[(1S)-1-carbomethoxy-3-methyl-butyl]carbamoyl]-2-hydroxy-propyl]carbamoyl]-2-methyl-butyl]carbamoyl]-4-keto-butyl]amino]-4-keto-butoxy]-2-naphthoxy]butanoylamino]-5-keto-pentanoyl]amino]-3-methyl-pentanoyl]amino]-3-hydroxy-butanoyl]amino]-4-methyl-valeric acid methyl ester
Formula:	C₆₂H₉₈N₁₀O₁₈
MolecularWeight:	1271.49772

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)O)C(=O)NC(CC(C)C)C(=O)OC)NC(=O)C(CCC(=O)N)NC(=O)CCCOC1=CC2=C(C=C1)C=CC(=C2)OCCCC(=O)NC(CCC(=O)N)C(=O)NC(C(C)CC)C(=O)NC(C(C)O)C(=O)NC(CC(C)C)C(=O)OC

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)O)C(=O)N[C@@H](CC(C)C)C(=O)OC)NC(=O)[C@H](CCC(=O)N)NC(=O)CCCOC1=CC2=C(C=C1)C=CC(=C2)OCCCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C(C)O)C(=O)N[C@@H](CC(C)C)C(=O)OC

InChI

InChI=1S/C62H98N10O18/c1-13-35(7)51(57(81)71-53(37(9)73)59(83)67-45(29-33(3)4)61(85)87-11)69-55(79)43(23-25-47(63)75)65-49(77)17-15-27-89-41-21-19-39-20-22-42(32-40(39)31-41)90-28-16-18-50(78)66-44(24-26-48(64)76)56(80)70-52(36(8)14-2)58(82)72-54(38(10)74)60(84)68-46(30-34(5)6)62(86)88-12/h19-22,31-38,43-46,51-54,73-74H,13-18,23-30H2,1-12H3,(H2,63,75)(H2,64,76)(H,65,77)(H,66,78)(H,67,83)(H,68,84)(H,69,79)(H,70,80)(H,71,81)(H,72,82)/t35-,36-,37?,38?,43-,44-,45-,46-,51-,52-,53-,54-/m0/s1

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