Twmewereinnytslihslieesqnqqekneqelleld

Structural Information

Molecular Formula

C₂₀₀H₃₀₅N₅₃O₇₁S

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC2=CNC=N2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)N

InChI

InChI=1S/C200H305N53O71S/c1-19-95(14)159(195(319)233-122(50-63-156(281)282)172(296)225-121(49-62-155(279)280)177(301)247-138(86-254)192(316)232-114(42-55-144(206)262)173(297)242-134(79-146(208)264)185(309)228-113(41-54-143(205)261)168(292)221-111(39-52-141(203)259)166(290)223-115(43-56-149(267)268)169(293)219-109(33-26-27-66-201)165(289)241-133(78-145(207)263)186(310)231-117(45-58-151(271)272)171(295)222-112(40-53-142(204)260)167(291)224-118(46-59-152(273)274)174(298)234-126(70-91(6)7)181(305)236-125(69-90(4)5)180(304)229-120(48-61-154(277)278)175(299)235-127(71-92(8)9)182(306)246-137(199(323)324)82-158(285)286)251-189(313)128(72-93(10)11)237-193(317)139(87-255)248-184(308)132(77-102-85-213-89-217-102)244-196(320)161(97(16)21-3)252-190(314)129(73-94(12)13)238-194(318)140(88-256)249-198(322)162(98(17)257)253-191(315)130(74-99-35-37-103(258)38-36-99)239-187(311)135(80-147(209)265)243-188(312)136(81-148(210)266)245-197(321)160(96(15)20-2)250-179(303)123(51-64-157(283)284)227-164(288)110(34-28-67-214-200(211)212)220-170(294)116(44-57-150(269)270)230-183(307)131(76-101-84-216-108-32-25-23-30-105(101)108)240-176(300)119(47-60-153(275)276)226-178(302)124(65-68-325-18)218-163(287)106(202)75-100-83-215-107-31-24-22-29-104(100)107/h22-25,29-32,35-38,83-85,89-98,106,109-140,159-162,215-216,254-258H,19-21,26-28,33-34,39-82,86-88,201-202H2,1-18H3,(H2,203,259)(H2,204,260)(H2,205,261)(H2,206,262)(H2,207,263)(H2,208,264)(H2,209,265)(H2,210,266)(H,213,217)(H,218,287)(H,219,293)(H,220,294)(H,221,292)(H,222,295)(H,223,290)(H,224,291)(H,225,296)(H,226,302)(H,227,288)(H,228,309)(H,229,304)(H,230,307)(H,231,310)(H,232,316)(H,233,319)(H,234,298)(H,235,299)(H,236,305)(H,237,317)(H,238,318)(H,239,311)(H,240,300)(H,241,289)(H,242,297)(H,243,312)(H,244,320)(H,245,321)(H,246,306)(H,247,301)(H,248,308)(H,249,322)(H,250,303)(H,251,313)(H,252,314)(H,253,315)(H,267,268)(H,269,270)(H,271,272)(H,273,274)(H,275,276)(H,277,278)(H,279,280)(H,281,282)(H,283,284)(H,285,286)(H,323,324)(H4,211,212,214)/t95-,96-,97-,98+,106-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,159-,160-,161-,162-/m0/s1

InChIKey

ZMMVQTSDCMHTDM-JOUBNWETSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-5-amino-2-[[(2S)-4-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-4-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-carboxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-carboxybutanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]amino]-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-hydroxypropanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-4-oxobutanoyl]amino]-4-carboxybutanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]butanedioic acid

Related CIDs

• CID 129909414