Riidllwrvrrpwkpkfvtvwv

Structural Information

Molecular Formula

C₁₄₆H₂₃₁N₄₃O₂₆

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)N[C@@H](CCCCN)C(=O)N6CCC[C@H]6C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC7=CC=CC=C7)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC8=CNC9=CC=CC=C98)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C=O)NC(=O)[C@H](CCCNC(=N)N)N

InChI

InChI=1S/C146H231N43O26/c1-18-83(15)117(186-138(212)118(84(16)19-2)185-120(194)94(149)46-34-60-161-143(152)153)137(211)180-109(72-112(192)193)128(202)175-103(66-77(3)4)124(198)174-104(67-78(5)6)125(199)177-106(69-87-73-165-95-47-26-23-43-91(87)95)126(200)169-100(53-36-62-163-145(156)157)123(197)181-114(80(9)10)134(208)171-99(52-35-61-162-144(154)155)121(195)172-102(54-37-63-164-146(158)159)141(215)189-65-39-56-111(189)132(206)178-107(70-88-74-166-96-48-27-24-44-92(88)96)127(201)173-101(51-30-32-58-148)140(214)188-64-38-55-110(188)131(205)170-98(50-29-31-57-147)122(196)176-105(68-86-40-21-20-22-41-86)129(203)183-116(82(13)14)136(210)187-119(85(17)191)139(213)184-115(81(11)12)135(209)179-108(71-89-75-167-97-49-28-25-45-93(89)97)130(204)182-113(79(7)8)133(207)168-90(76-190)42-33-59-160-142(150)151/h20-28,40-41,43-45,47-49,73-85,90,94,98-111,113-119,165-167,191H,18-19,29-39,42,46,50-72,147-149H2,1-17H3,(H,168,207)(H,169,200)(H,170,205)(H,171,208)(H,172,195)(H,173,201)(H,174,198)(H,175,202)(H,176,196)(H,177,199)(H,178,206)(H,179,209)(H,180,211)(H,181,197)(H,182,204)(H,183,203)(H,184,213)(H,185,194)(H,186,212)(H,187,210)(H,192,193)(H4,150,151,160)(H4,152,153,161)(H4,154,155,162)(H4,156,157,163)(H4,158,159,164)/t83-,84-,85+,90-,94-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,113-,114-,115-,116-,117-,118-,119-/m0/s1

InChIKey

NSUVTQBBLKIPEZ-NPJXZHCJSA-N

Compound name

(3S)-4-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-1-[[(2S)-6-amino-1-[(2S)-2-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxohexan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxohexan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-5-carbamimidamido-1-oxopentan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-[[(2S,3S)-2-[[(2S,3S)-2-[[(2S)-2-amino-5-carbamimidamidopentanoyl]amino]-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]-4-oxobutanoic acid

Related CIDs

• CID 16129743