D-wt

Structural Information

Molecular Formula

C₁₄₄H₂₄₁N₄₁O₄₁S₂

SMILES

CC[C@@H](C)[C@H](C(=O)NCC(=O)N[C@H](C)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](CC2=CC=CC=C2)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@H](CCSC)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CO)C(=O)N[C@H](CCSC)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@H](CC(C)C)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@H](C(C)C)C(=O)N[C@H](CCC(=O)N)C(=O)N[C@H](C)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CCC(=O)N)C(=O)N[C@H](CC(C)C)C(=O)O)NC(=O)CNC(=O)[C@@H](C(C)C)NC(=O)[C@@H](C)N

InChI

InChI=1S/C144H241N41O41S2/c1-28-75(16)112(180-109(198)65-158-136(219)110(73(12)13)181-116(199)76(17)145)137(220)159-62-106(195)162-80(21)120(203)173-95(55-70(6)7)130(213)176-98(59-86-39-33-30-34-40-86)132(215)175-94(54-69(4)5)124(207)157-64-107(196)165-97(58-85-37-31-29-32-38-85)131(214)174-93(53-68(2)3)123(206)156-61-105(194)160-78(19)118(201)163-77(18)117(200)154-63-108(197)166-100(66-186)135(218)185-113(82(23)188)139(222)172-91(47-51-227-26)122(205)155-60-104(193)161-79(20)119(202)167-88(42-36-50-153-144(150)151)127(210)179-101(67-187)134(217)170-92(48-52-228-27)129(212)183-114(83(24)189)140(223)177-96(56-71(8)9)133(216)184-115(84(25)190)141(224)182-111(74(14)15)138(221)171-89(43-45-102(146)191)125(208)164-81(22)121(204)168-87(41-35-49-152-143(148)149)126(209)169-90(44-46-103(147)192)128(211)178-99(142(225)226)57-72(10)11/h29-34,37-40,68-84,87-101,110-115,186-190H,28,35-36,41-67,145H2,1-27H3,(H2,146,191)(H2,147,192)(H,154,200)(H,155,205)(H,156,206)(H,157,207)(H,158,219)(H,159,220)(H,160,194)(H,161,193)(H,162,195)(H,163,201)(H,164,208)(H,165,196)(H,166,197)(H,167,202)(H,168,204)(H,169,209)(H,170,217)(H,171,221)(H,172,222)(H,173,203)(H,174,214)(H,175,215)(H,176,213)(H,177,223)(H,178,211)(H,179,210)(H,180,198)(H,181,199)(H,182,224)(H,183,212)(H,184,216)(H,185,218)(H,225,226)(H4,148,149,152)(H4,150,151,153)/t75-,76-,77-,78-,79-,80-,81-,82+,83+,84+,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,110-,111-,112-,113-,114-,115-/m1/s1

InChIKey

ARSCNMSMXJKCCH-VYMSMKLYSA-N

Compound name

(2R)-2-[[(2R)-5-amino-2-[[(2R)-2-[[(2R)-2-[[(2R)-5-amino-2-[[(2R)-2-[[(2R,3S)-2-[[(2R)-2-[[(2R,3S)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[2-[[(2R)-2-[[(2R,3S)-2-[[(2R)-2-[[2-[[(2R)-2-[[(2R)-2-[[2-[[(2R)-2-[[(2R)-2-[[2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-[[2-[[(2R,3R)-2-[[2-[[(2R)-2-[[(2R)-2-aminopropanoyl]amino]-3-methylbutanoyl]amino]acetyl]amino]-3-methylpentanoyl]amino]acetyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]propanoyl]amino]propanoyl]amino]acetyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylsulfanylbutanoyl]amino]acetyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoic acid

Related CIDs

• CID 16186455
• CID 16197748
• CID 16197749