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Substance Name: Viscotoxin B
RN: 11063-16-4
InChIKey: ZWPXAQXYYQZXSU-ZNZVWFPBSA-N

Molecular Formula

  • C197-H322-N64-O67-S6

Molecular Weight

  • 4851.4878
 
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Names and Synonyms

  • Viscotoxin B

Registry Numbers

CAS Registry Number

  • 11063-16-4

Other Registry Number

  • 12583-90-3

System Generated Number

  • 0011063164

Structure Descriptors

InChI

1S/C197H322N64O67S6/c1-17-91(8)146-184(318)239-114(65-100-43-47-102(273)48-44-100)165(299)236-116(68-137(203)276)168(302)255-150(97(14)270)187(321)249-130-86-331-330-84-128(247-161(295)109(39-29-59-216-197(211)212)227-162(296)110(51-52-144(283)284)231-159(293)107(37-27-57-214-195(207)208)228-171(305)121(77-263)225-141(280)73-218-139(278)71-217-140(279)72-219-156(290)112(63-89(4)5)233-160(294)108(230-178(130)312)38-28-58-215-196(209)210)176(310)223-95(12)154(288)241-123(79-265)172(306)234-113(64-90(6)7)164(298)244-120(76-262)157(291)220-74-143(282)226-127-83-329-333-87-131(191(325)260-61-31-41-134(260)181(315)238-117(69-138(204)277)169(303)256-152(99(16)272)189(323)258-149(96(13)269)183(317)221-75-142(281)224-105(36-26-56-213-194(205)206)158(292)235-115(67-136(202)275)167(301)253-146)250-179(313)129(248-174(308)124(80-266)243-155(289)104(201)33-20-23-53-198)85-332-334-88-132(251-188(322)151(98(15)271)257-175(309)126(82-268)242-153(287)94(11)222-170(304)122(78-264)246-185(319)147(92(9)18-2)254-186(320)148(93(10)19-3)252-163(297)106(229-177(127)311)34-21-24-54-199)192(326)261-62-32-42-135(261)182(316)245-125(81-267)173(307)237-118(70-145(285)286)166(300)240-119(66-101-45-49-103(274)50-46-101)190(324)259-60-30-40-133(259)180(314)232-111(193(327)328)35-22-25-55-200/h43-50,89-99,104-135,146-152,262-274H,17-42,51-88,198-201H2,1-16H3,(H2,202,275)(H2,203,276)(H2,204,277)(H,217,279)(H,218,278)(H,219,290)(H,220,291)(H,221,317)(H,222,304)(H,223,310)(H,224,281)(H,225,280)(H,226,282)(H,227,296)(H,228,305)(H,229,311)(H,230,312)(H,231,293)(H,232,314)(H,233,294)(H,234,306)(H,235,292)(H,236,299)(H,237,307)(H,238,315)(H,239,318)(H,240,300)(H,241,288)(H,242,287)(H,243,289)(H,244,298)(H,245,316)(H,246,319)(H,247,295)(H,248,308)(H,249,321)(H,250,313)(H,251,322)(H,252,297)(H,253,301)(H,254,320)(H,255,302)(H,256,303)(H,257,309)(H,258,323)(H,283,284)(H,285,286)(H,327,328)(H4,205,206,213)(H4,207,208,214)(H4,209,210,215)(H4,211,212,216)/t91-,92-,93-,94-,95-,96+,97+,98+,99+,104-,105-,106-,107-,108-,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-,146-,147-,148-,149-,150-,151-,152-/m0/s1

InChIKey

ZWPXAQXYYQZXSU-ZNZVWFPBSA-N

Smiles

CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H]2CSSC[C@@H](C(=O)N[C@H](C(=O)N1)CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]3CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3)CCCNC(=N)N)CCC(=O)O)CCCNC(=N)N)CO)CC(C)C)CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]4CCCN4C2=O)CC(=O)N)[C@@H](C)O)[C@@H](C)O)CCCNC(=N)N)CC(=O)N)[C@@H](C)CC)Cc5ccc(cc5)O)CC(=O)N)[C@@H](C)O)C)CO)CC(C)C)CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)N)C(=O)N6CCC[C@H]6C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc7ccc(cc7)O)C(=O)N8CCC[C@H]8C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)CO)C)CO)[C@@H](C)CC