(hexadecane)-rqllsgivqqqnnllraieaqqhllqk

Structural Information

Molecular Formula

C₁₅₂H₂₆₇N₄₅O₄₀

SMILES

CCCCCCCCCCCCCCCCN[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H]([C@@H](C)CC)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)N[C@@H](CCCCN)C(=O)O

InChI

InChI=1S/C152H267N45O40/c1-22-25-26-27-28-29-30-31-32-33-34-35-36-39-62-168-90(43-40-63-169-151(163)164)128(214)177-95(48-56-114(157)202)135(221)185-103(67-80(8)9)140(226)188-106(70-83(14)15)143(229)194-110(76-198)127(213)171-75-120(208)195-123(85(18)23-2)149(235)196-122(84(16)17)147(233)182-98(51-59-117(160)205)133(219)178-93(46-54-112(155)200)132(218)180-97(50-58-116(159)204)137(223)192-108(72-118(161)206)146(232)193-109(73-119(162)207)145(231)190-105(69-82(12)13)142(228)186-101(65-78(4)5)138(224)176-91(44-41-64-170-152(165)166)129(215)174-88(21)126(212)197-124(86(19)24-3)148(234)183-99(52-60-121(209)210)130(216)173-87(20)125(211)175-92(45-53-111(154)199)131(217)179-96(49-57-115(158)203)136(222)191-107(71-89-74-167-77-172-89)144(230)189-104(68-81(10)11)141(227)187-102(66-79(6)7)139(225)181-94(47-55-113(156)201)134(220)184-100(150(236)237)42-37-38-61-153/h74,77-88,90-110,122-124,168,198H,22-73,75-76,153H2,1-21H3,(H2,154,199)(H2,155,200)(H2,156,201)(H2,157,202)(H2,158,203)(H2,159,204)(H2,160,205)(H2,161,206)(H2,162,207)(H,167,172)(H,171,213)(H,173,216)(H,174,215)(H,175,211)(H,176,224)(H,177,214)(H,178,219)(H,179,217)(H,180,218)(H,181,225)(H,182,233)(H,183,234)(H,184,220)(H,185,221)(H,186,228)(H,187,227)(H,188,226)(H,189,230)(H,190,231)(H,191,222)(H,192,223)(H,193,232)(H,194,229)(H,195,208)(H,196,235)(H,197,212)(H,209,210)(H,236,237)(H4,163,164,169)(H4,165,166,170)/t85-,86-,87-,88-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,122-,123-,124-/m0/s1

InChIKey

TVLHYGOWZMQQCY-RHCHEQEESA-N

Compound name

(2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-4-amino-2-[[(2S)-5-amino-2-[[(2S)-5-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-5-carbamimidamido-2-(hexadecylamino)pentanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoyl]amino]hexanoic acid

Related CIDs

• CID 71591495