(dodecane)-rqllsgivqqqnnllraieaqqhllqk

Structural Information

Molecular Formula

C₁₄₈H₂₅₉N₄₅O₄₀

SMILES

CCCCCCCCCCCCN[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/C148H259N45O40/c1-22-25-26-27-28-29-30-31-32-35-58-164-86(39-36-59-165-147(159)160)124(210)173-91(44-52-110(153)198)131(217)181-99(63-76(8)9)136(222)184-102(66-79(14)15)139(225)190-106(72-194)123(209)167-71-116(204)191-119(81(18)23-2)145(231)192-118(80(16)17)143(229)178-94(47-55-113(156)201)129(215)174-89(42-50-108(151)196)128(214)176-93(46-54-112(155)200)133(219)188-104(68-114(157)202)142(228)189-105(69-115(158)203)141(227)186-101(65-78(12)13)138(224)182-97(61-74(4)5)134(220)172-87(40-37-60-166-148(161)162)125(211)170-84(21)122(208)193-120(82(19)24-3)144(230)179-95(48-56-117(205)206)126(212)169-83(20)121(207)171-88(41-49-107(150)195)127(213)175-92(45-53-111(154)199)132(218)187-103(67-85-70-163-73-168-85)140(226)185-100(64-77(10)11)137(223)183-98(62-75(6)7)135(221)177-90(43-51-109(152)197)130(216)180-96(146(232)233)38-33-34-57-149/h70,73-84,86-106,118-120,164,194H,22-69,71-72,149H2,1-21H3,(H2,150,195)(H2,151,196)(H2,152,197)(H2,153,198)(H2,154,199)(H2,155,200)(H2,156,201)(H2,157,202)(H2,158,203)(H,163,168)(H,167,209)(H,169,212)(H,170,211)(H,171,207)(H,172,220)(H,173,210)(H,174,215)(H,175,213)(H,176,214)(H,177,221)(H,178,229)(H,179,230)(H,180,216)(H,181,217)(H,182,224)(H,183,223)(H,184,222)(H,185,226)(H,186,227)(H,187,218)(H,188,219)(H,189,228)(H,190,225)(H,191,204)(H,192,231)(H,193,208)(H,205,206)(H,232,233)(H4,159,160,165)(H4,161,162,166)/t81-,82-,83-,84-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,118-,119-,120-/m0/s1

InChIKey

DDKUSGBBYRUSAS-BVQGPHNRSA-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-(dodecylamino)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 71591494