16-[[(2s)-1-[[2-[[(2s,3s)-1-[[(2s)-1-[[(2s)-5-amino-1-[[(2s)-5-amino-1-[[(2s)-5-amino-1-[[(2s)-4-amino-1-[[(2s)-4-amino-1-[[(2s)-1-[[(2s)-1-[[(2s)-1-[[(2s)-1-[[(2s,3s)-1-[[(2s)-1-[[(2s)-1-[[(2s)-5-amino-1-[[(2s)-5-amino-1-[[(2s)-1-[[(2s)-1-[[(2s)-1-[[(1s)-4-amino-1-carboxy-4-oxobutyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1h-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]hexadecanoic acid

Structural Information

Molecular Formula

C₁₂₃H₂₁₁N₃₅O₃₆

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)CNC(=O)[C@H](CO)NCCCCCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C123H211N35O36/c1-17-67(13)100(156-96(168)59-137-104(175)87(60-159)135-49-31-29-27-25-23-21-19-20-22-24-26-28-30-34-97(169)170)121(192)157-99(66(11)12)119(190)146-77(39-46-92(128)164)109(180)143-74(36-43-89(125)161)108(179)145-76(38-45-91(127)163)111(182)154-85(56-94(130)166)118(189)155-86(57-95(131)167)117(188)152-83(54-65(9)10)115(186)149-80(51-62(3)4)112(183)142-72(33-32-50-136-123(132)133)105(176)140-70(16)103(174)158-101(68(14)18-2)120(191)147-78(41-48-98(171)172)106(177)139-69(15)102(173)141-73(35-42-88(124)160)107(178)144-75(37-44-90(126)162)110(181)153-84(55-71-58-134-61-138-71)116(187)151-82(53-64(7)8)114(185)150-81(52-63(5)6)113(184)148-79(122(193)194)40-47-93(129)165/h58,61-70,72-87,99-101,135,159H,17-57,59-60H2,1-16H3,(H2,124,160)(H2,125,161)(H2,126,162)(H2,127,163)(H2,128,164)(H2,129,165)(H2,130,166)(H2,131,167)(H,134,138)(H,137,175)(H,139,177)(H,140,176)(H,141,173)(H,142,183)(H,143,180)(H,144,178)(H,145,179)(H,146,190)(H,147,191)(H,148,184)(H,149,186)(H,150,185)(H,151,187)(H,152,188)(H,153,181)(H,154,182)(H,155,189)(H,156,168)(H,157,192)(H,158,174)(H,169,170)(H,171,172)(H,193,194)(H4,132,133,136)/t67-,68-,69-,70-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,99-,100-,101-/m0/s1

InChIKey

OLHUDHHIOQVFHR-JKYWYPQMSA-N

Compound name

16-[[(2S)-1-[[2-[[(2S,3S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-5-amino-1-[[(2S)-5-amino-1-[[(2S)-4-amino-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(1S)-4-amino-1-carboxy-4-oxobutyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]hexadecanoic acid

Related CIDs

• CID 86575206