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Substance Name: Neurotoxin II-5 (Notechis scutatus scutatus reduced)
RN: 70294-13-2
InChIKey: BTLPDGIBSMVLKZ-LNLHQETKSA-N

Molecular Formula

  • C586-H844-N168-O176-S16

Molecular Weight

  • 13676.5167
 
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Names and Synonyms

Synonym

  • Notechis II-5

Systematic Name

  • Neurotoxin II-5 (Notechis scutatus scutatus reduced)

Registry Numbers

CAS Registry Number

  • 70294-13-2

System Generated Number

  • 0070294132

Structure Descriptors

InChI

1S/C589H883N169O177S16/c1-38-289(21)466(572(924)680-346(109-65-75-187-597)496(848)667-342(105-61-71-183-593)493(845)669-344(107-63-73-185-595)501(853)735-417(272-944)557(909)695-364(204-281(5)6)515(867)672-349(113-79-191-630-584(614)615)498(850)698-381(211-307-96-52-45-53-97-307)543(895)745-464(287(17)18)571(923)742-422(277-949)561(913)720-400(241-458(817)818)540(892)740-420(275-947)560(912)721-402(243-460(821)822)546(898)746-463(286(15)16)569(921)684-357(168-175-449(799)800)490(842)651-293(25)473(825)650-294(26)476(828)688-370(209-305-92-48-43-49-93-305)524(876)738-418(273-945)558(910)703-369(208-304-90-46-42-47-91-304)512(864)652-295(27)474(826)664-340(103-59-69-181-591)489(841)657-300(32)578(930)755-198-86-120-424(755)565(917)723-379(220-316-140-160-331(775)161-141-316)521(873)712-391(232-436(609)785)533(885)711-388(229-433(606)782)513(865)653-297(29)478(830)690-389(230-434(607)783)531(883)706-383(223-319-246-637-337-101-57-55-99-334(319)337)528(880)713-393(234-438(611)787)545(897)751-469(292(24)41-4)575(927)726-403(244-461(823)824)547(899)752-470(301(33)764)576(928)681-347(110-66-76-188-598)497(849)668-343(106-62-72-184-594)494(846)671-351(115-81-193-632-586(618)619)502(854)734-416(271-943)556(908)687-363(582(934)935)166-173-430(603)779)750-544(896)392(233-437(610)786)710-499(851)350(114-80-192-631-585(616)617)675-554(906)414(269-941)737-527(879)380(221-317-142-162-332(776)163-143-317)722-563(915)423-119-85-197-754(423)447(796)258-646-485(837)387(228-432(605)781)709-504(856)354(167-174-448(797)798)659-442(791)253-644-487(839)409(264-936)731-525(877)377(218-314-136-156-329(773)157-137-314)699-520(872)374(215-311-130-150-326(770)151-131-311)701-537(889)397(238-455(811)812)716-518(870)371(213-309-126-146-324(768)147-127-309)689-477(829)298(30)655-548(900)405(260-760)727-510(862)361(179-203-951-37)677-495(847)345(108-64-74-186-596)679-564(916)425-121-87-200-757(425)580(932)408(263-763)730-553(905)412(267-939)663-444(793)255-640-481(833)338(102-58-68-180-590)666-492(844)341(104-60-70-182-592)670-505(857)358(169-176-450(801)802)665-475(827)296(28)654-514(866)394(235-452(805)806)719-550(902)407(262-762)729-523(875)376(217-313-134-154-328(772)155-135-313)705-559(911)419(274-946)739-539(891)399(240-457(815)816)718-538(890)398(239-456(813)814)717-530(882)386(226-322-249-628-280-649-322)724-574(926)468(291(23)40-3)748-511(863)348(111-67-77-189-599)674-555(907)415(270-942)741-562(914)421(276-948)736-503(855)352(116-82-194-633-587(620)621)673-534(886)395(236-453(807)808)715-516(868)365(205-282(7)8)693-507(859)359(170-177-451(803)804)676-535(887)401(242-459(819)820)725-570(922)465(288(19)20)747-566(918)427-123-89-201-758(427)581(933)472(303(35)766)743-446(795)257-643-486(838)404(259-759)661-440(789)251-638-439(788)250-639-483(835)382(222-318-245-636-336-100-56-54-98-333(318)336)660-443(792)254-645-488(840)410(265-937)732-526(878)378(219-315-138-158-330(774)159-139-315)704-552(904)411(266-938)662-445(794)256-641-482(834)368(212-308-124-144-323(767)145-125-308)696-536(888)396(237-454(809)810)714-509(861)360(178-202-950-36)678-517(869)373(214-310-128-148-325(769)149-129-310)700-529(881)385(225-321-248-627-279-648-321)708-500(852)353(117-83-195-634-588(622)623)682-577(929)471(302(34)765)753-567(919)426-122-88-199-756(426)579(931)362(118-84-196-635-589(624)625)686-491(843)339(112-78-190-629-583(612)613)658-441(790)252-642-484(836)384(224-320-247-626-278-647-320)707-532(884)390(231-435(608)784)691-479(831)299(31)656-551(903)413(268-940)733-508(860)356(165-172-429(602)778)685-573(925)467(290(22)39-2)749-542(894)367(207-284(11)12)694-519(871)375(216-312-132-152-327(771)153-133-312)702-549(901)406(261-761)728-522(874)372(210-306-94-50-44-51-95-306)697-506(858)355(164-171-428(601)777)683-568(920)462(285(13)14)744-541(893)366(206-283(9)10)692-480(832)335(600)227-431(604)780/h42-57,90-101,124-163,245-249,278-303,335,338-427,462-472,636-637,759-776,936-949H,38-41,58-89,102-123,164-244,250-277,590-600H2,1-37H3,(H2,601,777)(H2,602,778)(H2,603,779)(H2,604,780)(H2,605,781)(H2,606,782)(H2,607,783)(H2,608,784)(H2,609,785)(H2,610,786)(H2,611,787)(H,626,647)(H,627,648)(H,628,649)(H,638,788)(H,639,835)(H,640,833)(H,641,834)(H,642,836)(H,643,838)(H,644,839)(H,645,840)(H,646,837)(H,650,825)(H,651,842)(H,652,864)(H,653,865)(H,654,866)(H,655,900)(H,656,903)(H,657,841)(H,658,790)(H,659,791)(H,660,792)(H,661,789)(H,662,794)(H,663,793)(H,664,826)(H,665,827)(H,666,844)(H,667,848)(H,668,849)(H,669,845)(H,670,857)(H,671,846)(H,672,867)(H,673,886)(H,674,907)(H,675,906)(H,676,887)(H,677,847)(H,678,869)(H,679,916)(H,680,924)(H,681,928)(H,682,929)(H,683,920)(H,684,921)(H,685,925)(H,686,843)(H,687,908)(H,688,828)(H,689,829)(H,690,830)(H,691,831)(H,692,832)(H,693,859)(H,694,871)(H,695,909)(H,696,888)(H,697,858)(H,698,850)(H,699,872)(H,700,881)(H,701,889)(H,702,901)(H,703,910)(H,704,904)(H,705,911)(H,706,883)(H,707,884)(H,708,852)(H,709,856)(H,710,851)(H,711,885)(H,712,873)(H,713,880)(H,714,861)(H,715,868)(H,716,870)(H,717,882)(H,718,890)(H,719,902)(H,720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InChIKey

BTLPDGIBSMVLKZ-LNLHQETKSA-N

Smiles

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