Riidllwrvrrpwwpkfvtvwv

Structural Information

Molecular Formula

C₁₅₁H₂₂₉N₄₃O₂₆

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](CC6=CNC7=CC=CC=C76)C(=O)N8CCC[C@H]8C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC9=CC=CC=C9)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](CC1=CNC2=CC=CC=C21)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/C151H229N43O26/c1-18-85(15)122(191-143(217)123(86(16)19-2)190-125(199)98(153)47-34-60-165-148(156)157)142(216)184-113(73-117(197)198)133(207)179-107(66-79(3)4)129(203)178-108(67-80(5)6)130(204)181-110(69-89-74-169-99-48-27-23-43-94(89)99)131(205)174-105(54-36-62-167-150(160)161)128(202)186-119(82(9)10)139(213)176-104(53-35-61-166-149(158)159)126(200)177-106(55-37-63-168-151(162)163)145(219)193-64-38-57-116(193)137(211)182-111(70-90-75-170-100-49-28-24-44-95(90)100)132(206)185-114(72-92-77-172-102-51-30-26-46-97(92)102)146(220)194-65-39-56-115(194)136(210)175-103(52-31-32-58-152)127(201)180-109(68-88-40-21-20-22-41-88)134(208)188-121(84(13)14)141(215)192-124(87(17)196)144(218)189-120(83(11)12)140(214)183-112(71-91-76-171-101-50-29-25-45-96(91)101)135(209)187-118(81(7)8)138(212)173-93(78-195)42-33-59-164-147(154)155/h20-30,40-41,43-46,48-51,74-87,93,98,103-116,118-124,169-172,196H,18-19,31-39,42,47,52-73,152-153H2,1-17H3,(H,173,212)(H,174,205)(H,175,210)(H,176,213)(H,177,200)(H,178,203)(H,179,207)(H,180,201)(H,181,204)(H,182,211)(H,183,214)(H,184,216)(H,185,206)(H,186,202)(H,187,209)(H,188,208)(H,189,218)(H,190,199)(H,191,217)(H,192,215)(H,197,198)(H4,154,155,164)(H4,156,157,165)(H4,158,159,166)(H4,160,161,167)(H4,162,163,168)/t85-,86-,87+,93-,98-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,118-,119-,120-,121-,122-,123-,124-/m0/s1

InChIKey

CHWXKIRFQPRDQQ-VKOPBPBBSA-N

Compound name

(3S)-4-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-1-[[(2S)-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]-3-(1H-indol-3-yl)-1-oxopropan-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 16129745