Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Myotoxin 4 (Crotalus viridis viridis reduced)
RN: 111775-83-8
InChIKey: GXCULDPZIRINHU-YOTWNYPSSA-N

Molecular Formula

  • C223-H349-N65-O56-S7

Molecular Weight

  • 5061.0711
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • alpha-Crotamine (reduced), 3-L-arginine-8-L-glutamic acid-15-L-threonine-16-L-valine-33-L-lysine-42-L-valine-42a-L-asparagine-
  • Myotoxin I (Crotalus viridis concolor reduced)

Systematic Name

  • Myotoxin 4 (Crotalus viridis viridis reduced)

Registry Numbers

CAS Registry Number

  • 111775-83-8

System Generated Number

  • 0111775838

Structure Descriptors

InChI

1S/C223H349N65O56S7/c1-11-121(8)180(284-215(337)179(120(6)7)283-217(339)181(122(9)292)285-196(318)144(61-30-39-82-232)264-212(334)168-64-42-85-286(168)219(341)157(92-124-47-16-13-17-48-124)272-209(331)165(113-348)278-199(321)152(95-128-102-239-116-248-128)251-173(296)105-246-184(306)147(71-72-175(298)299)262-190(312)139(56-25-34-77-227)255-189(311)140(57-26-35-78-228)259-200(322)153(96-129-103-240-117-249-129)268-208(330)164(112-347)276-194(316)146(63-41-84-242-223(237)238)256-187(309)138(55-24-33-76-226)253-182(304)133(233)90-125-67-69-130(293)70-68-125)216(338)281-167(115-350)210(332)271-156(89-118(2)3)218(340)288-87-44-66-170(288)220(342)287-86-43-65-169(287)213(335)275-161(109-291)204(326)274-160(108-290)203(325)270-154(98-176(300)301)201(323)265-149(91-123-45-14-12-15-46-123)185(307)247-104-172(295)250-137(54-23-32-75-225)186(308)263-148(73-88-351-10)195(317)269-155(99-177(302)303)202(324)279-162(110-345)206(328)261-145(62-40-83-241-222(235)236)192(314)267-151(94-127-101-244-135-52-21-19-50-132(127)135)197(319)257-142(59-28-37-80-230)191(313)266-150(93-126-100-243-134-51-20-18-49-131(126)134)198(320)258-143(60-29-38-81-231)193(315)277-166(114-349)211(333)280-163(111-346)207(329)260-141(58-27-36-79-229)188(310)254-136(53-22-31-74-224)183(305)245-106-174(297)252-159(107-289)205(327)282-178(119(4)5)214(336)273-158(221(343)344)97-171(234)294/h12-21,45-52,67-70,100-103,116-122,133,136-170,178-181,243-244,289-293,345-350H,11,22-44,53-66,71-99,104-115,224-233H2,1-10H3,(H2,234,294)(H,239,248)(H,240,249)(H,245,305)(H,246,306)(H,247,307)(H,250,295)(H,251,296)(H,252,297)(H,253,304)(H,254,310)(H,255,311)(H,256,309)(H,257,319)(H,258,320)(H,259,322)(H,260,329)(H,261,328)(H,262,312)(H,263,308)(H,264,334)(H,265,323)(H,266,313)(H,267,314)(H,268,330)(H,269,317)(H,270,325)(H,271,332)(H,272,331)(H,273,336)(H,274,326)(H,275,335)(H,276,316)(H,277,315)(H,278,321)(H,279,324)(H,280,333)(H,281,338)(H,282,327)(H,283,339)(H,284,337)(H,285,318)(H,298,299)(H,300,301)(H,302,303)(H,343,344)(H4,235,236,241)(H4,237,238,242)/t121-,122+,133-,136-,137-,138-,139-,140-,141-,142-,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-,178-,179-,180-,181-/m0/s1

InChIKey

GXCULDPZIRINHU-YOTWNYPSSA-N

Smiles

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CS)NC(=O)[C@H](Cc3cnc[nH]3)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc4cnc[nH]4)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc5ccc(O)cc5)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N6CCC[C@H]6C(=O)N7CCC[C@H]7C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc8ccccc8)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc9c[nH]c%10ccccc9%10)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc%11c[nH]c%12ccccc%11%12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)O