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Molecular weight: 4720.64
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Iso. SMILES:
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CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)NCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N4CCC[C@H]4C(=O)N5CCC[C@H]5C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC6=CC=CC=C6)C(=O)N7CCC[C@H]7C(=O)N8CCC[C@H]8C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC9=CC=CC=C9)C(=O)N%10CCC[C@H]%10C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%11CCCN%11C(=O)[C@@H]%12CCCN%12C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%13CCCN%13C(=O)[C@@H]%14CCCN%14C(=O)[C@H](CC%15=CC=CC=C%15)NC(=O)[C@H](CC%16=CC=CC=C%16)NC(=O)[C@@H]%17CCCN%17C(=O)[C@@H]%18CCCN%18C(=O)[C@@H]%19CCCN%19C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%20CCCN%20C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%21CCCN%21C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC%22=CC=C(C=C%22)O)NC(=O)[C@@H]%23CCCN%23C(=O)[C@@H]%24CCCN%24C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%25CCCN%25C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)N
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InChI Key:
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JTJJGVCUEGCBHL-IWDHFESKSA-N
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Can. SMILES:
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CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)NCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N4CCC[C@H]4C(=O)N5CCC[C@H]5C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC6=CC=CC=C6)C(=O)N7CCC[C@H]7C(=O)N8CCC[C@H]8C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC9=CC=CC=C9)C(=O)N%10CCC[C@H]%10C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%11CCCN%11C(=O)[C@@H]%12CCCN%12C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%13CCCN%13C(=O)[C@@H]%14CCCN%14C(=O)[C@H](CC%15=CC=CC=C%15)NC(=O)[C@H](CC%16=CC=CC=C%16)NC(=O)[C@@H]%17CCCN%17C(=O)[C@@H]%18CCCN%18C(=O)[C@@H]%19CCCN%19C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%20CCCN%20C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%21CCCN%21C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC%22=CC=C(C=C%22)O)NC(=O)[C@@H]%23CCCN%23C(=O)[C@@H]%24CCCN%24C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]%25CCCN%25C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)N
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InChI:
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InChI=1S/C229H345N69O41/c1-7-135(6)181(218(337)297-122-50-89-178(297)216(335)283-108-33-72-161(283)190(309)261-132-180(300)262-157(128-137-54-15-9-16-55-137)206(325)293-118-46-84-173(293)212(331)284-109-37-77-166(284)192(311)265-146(65-26-98-254-223(237)238)185(304)276-158(129-138-56-17-10-18-57-138)207(326)294-119-47-85-174(294)213(332)286-111-39-78-167(286)193(312)266-147(66-27-99-255-224(239)240)186(305)277-160(131-140-60-21-12-22-61-140)209(328)298-123-51-90-179(298)219(338)339)279-187(306)148(67-28-100-256-225(241)242)267-194(313)168-79-40-112-287(168)211(330)172-83-45-117-292(172)205(324)156(125-134(4)5)274-184(303)145(64-25-97-253-222(235)236)264-191(310)165-76-38-110-285(165)214(333)175-86-48-120-295(175)208(327)159(130-139-58-19-11-20-59-139)278-189(308)153(126-136-52-13-8-14-53-136)272-198(317)170-81-42-114-289(170)215(334)177-88-49-121-296(177)217(336)176-87-44-116-291(176)203(322)152(71-32-104-260-229(249)250)271-196(315)163-74-35-106-281(163)201(320)150(69-30-102-258-227(245)246)269-197(316)164-75-36-107-282(164)204(323)155(124-133(2)3)275-188(307)154(127-141-91-93-142(299)94-92-141)273-199(318)169-80-41-113-288(169)210(329)171-82-43-115-290(171)202(321)151(70-31-103-259-228(247)248)270-195(314)162-73-34-105-280(162)200(319)149(68-29-101-257-226(243)244)268-183(302)144(63-24-96-252-221(233)234)263-182(301)143(230)62-23-95-251-220(231)232/h8-22,52-61,91-94,133-135,143-179,181,299H,7,23-51,62-90,95-132,230H2,1-6H3,(H,261,309)(H,262,300)(H,263,301)(H,264,310)(H,265,311)(H,266,312)(H,267,313)(H,268,302)(H,269,316)(H,270,314)(H,271,315)(H,272,317)(H,273,318)(H,274,303)(H,275,307)(H,276,304)(H,277,305)(H,278,308)(H,279,306)(H,338,339)(H4,231,232,251)(H4,233,234,252)(H4,235,236,253)(H4,237,238,254)(H4,239,240,255)(H4,241,242,256)(H4,243,244,257)(H4,245,246,258)(H4,247,248,259)(H4,249,250,260)/t135-,143-,144-,145-,146-,147-,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,158-,159-,160-,161-,162-,163-,164-,165-,166-,167-,168-,169-,170-,171-,172-,173-,174-,175-,176-,177-,178-,179-,181-/m0/s1
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