T-2410

Structural Information

Molecular Formula

C₂₀₆H₃₁₇N₅₅O₇₁S₂

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=CN=CN2)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)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=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)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCSC)NC(=O)C

InChI

InChI=1S/C206H317N55O71S2/c1-22-98(14)163(201(328)239-125(52-64-160(289)290)176(303)231-124(51-63-159(287)288)181(308)254-143(89-262)198(325)237-118(45-57-149(211)272)178(305)248-139(82-151(213)274)190(317)234-117(44-56-148(210)271)173(300)227-115(42-54-146(208)269)171(298)229-119(46-58-154(277)278)174(301)225-113(36-29-30-68-207)170(297)247-138(81-150(212)273)191(318)236-120(47-59-155(279)280)175(302)228-116(43-55-147(209)270)172(299)230-122(49-61-157(283)284)179(306)241-131(74-95(8)9)186(313)242-130(73-94(6)7)185(312)235-121(48-60-156(281)282)177(304)240-129(168(216)295)72-93(4)5)258-195(322)132(75-96(10)11)243-199(326)144(90-263)255-189(316)137(80-107-88-219-92-223-107)252-202(329)165(100(16)24-3)259-196(323)133(76-97(12)13)244-200(327)145(91-264)256-205(332)167(102(18)266)261-197(324)134(77-104-38-40-108(268)41-39-104)245-192(319)140(83-152(214)275)249-193(320)141(84-153(215)276)253-203(330)164(99(15)23-2)257-183(310)126(53-65-161(291)292)233-169(296)114(37-31-69-220-206(217)218)226-194(321)142(85-162(293)294)250-188(315)135(78-105-86-221-111-34-27-25-32-109(105)111)246-180(307)123(50-62-158(285)286)232-182(309)128(67-71-334-21)238-187(314)136(79-106-87-222-112-35-28-26-33-110(106)112)251-204(331)166(101(17)265)260-184(311)127(66-70-333-20)224-103(19)267/h25-28,32-35,38-41,86-88,92-102,113-145,163-167,221-222,262-266,268H,22-24,29-31,36-37,42-85,89-91,207H2,1-21H3,(H2,208,269)(H2,209,270)(H2,210,271)(H2,211,272)(H2,212,273)(H2,213,274)(H2,214,275)(H2,215,276)(H2,216,295)(H,219,223)(H,224,267)(H,225,301)(H,226,321)(H,227,300)(H,228,302)(H,229,298)(H,230,299)(H,231,303)(H,232,309)(H,233,296)(H,234,317)(H,235,312)(H,236,318)(H,237,325)(H,238,314)(H,239,328)(H,240,304)(H,241,306)(H,242,313)(H,243,326)(H,244,327)(H,245,319)(H,246,307)(H,247,297)(H,248,305)(H,249,320)(H,250,315)(H,251,331)(H,252,329)(H,253,330)(H,254,308)(H,255,316)(H,256,332)(H,257,310)(H,258,322)(H,259,323)(H,260,311)(H,261,324)(H,277,278)(H,279,280)(H,281,282)(H,283,284)(H,285,286)(H,287,288)(H,289,290)(H,291,292)(H,293,294)(H4,217,218,220)/t98-,99-,100-,101+,102+,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-,141-,142-,143-,144-,145-,163-,164-,165-,166-,167-/m0/s1

InChIKey

QDBNVOCWYONZIS-OUZHNUNXSA-N

Compound name

(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-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)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-acetamido-4-methylsulfanylbutanoyl]amino]-3-hydroxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-carboxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-carboxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-4-amino-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-hydroxypropanoyl]amino]-5-amino-5-oxopentanoyl]amino]-4-amino-4-oxobutanoyl]amino]-5-amino-5-oxopentanoyl]amino]-5-amino-5-oxopentanoyl]amino]-5-[[(2S)-6-amino-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-oxopentanoic acid

Related CIDs

• CID 49768001