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Substance Name: Thymosin beta(8)
RN: 81775-03-3
InChIKey: WMWQLAQXXNQPGF-NNUQXLMXSA-N

Molecular Formula

  • C195-H324-N52-O70

Molecular Weight

  • 4516.9986
 
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Names and Synonyms

Name of Substance

  • Thymosin beta(8)

Systematic Name

  • Thymosin beta4 (ox), 1-(N-acetyl-L-alanine)-6-L-leucine-7-glycine-10-L-asparagine-11-L-serine-15-L-alanine-27-L-threonine-30-L-threonine-40-de-L-alanine-41-deglycine-42-de-L-glutamic acid-43-de-L-serine-

Registry Numbers

CAS Registry Number

  • 81775-03-3

System Generated Number

  • 0081775033

Structure Descriptors

InChI

1S/C195H324N52O70/c1-19-96(9)151(239-173(294)114(57-66-142(261)262)212-141(260)91-209-160(281)124(82-93(3)4)230-181(302)131(90-150(277)278)235-184(305)134-52-40-80-246(134)193(314)122(51-31-39-79-203)227-180(301)129(88-148(273)274)229-158(279)98(11)210-105(18)254)187(308)236-127(86-139(207)258)178(299)238-133(92-248)183(304)232-126(85-106-42-22-21-23-43-106)177(298)234-130(89-149(275)276)179(300)217-107(44-24-32-72-196)161(282)211-99(12)159(280)213-108(45-25-33-73-197)165(286)231-125(83-94(5)6)176(297)218-109(46-26-34-74-198)162(283)216-113(50-30-38-78-202)172(293)241-153(100(13)249)189(310)226-121(62-71-147(271)272)175(296)242-154(101(14)250)188(309)225-116(55-64-137(205)256)168(289)221-118(59-68-144(265)266)170(291)215-111(48-28-36-76-200)166(287)233-128(87-140(208)259)182(303)244-155(102(15)251)191(312)237-132(84-95(7)8)194(315)247-81-41-53-135(247)185(306)245-156(103(16)252)190(311)223-112(49-29-37-77-201)163(284)222-120(61-70-146(269)270)174(295)243-157(104(17)253)192(313)240-152(97(10)20-2)186(307)224-119(60-69-145(267)268)171(292)219-115(54-63-136(204)255)167(288)220-117(58-67-143(263)264)169(290)214-110(47-27-35-75-199)164(285)228-123(195(316)317)56-65-138(206)257/h21-23,42-43,93-104,107-135,151-157,248-253H,19-20,24-41,44-92,196-203H2,1-18H3,(H2,204,255)(H2,205,256)(H2,206,257)(H2,207,258)(H2,208,259)(H,209,281)(H,210,254)(H,211,282)(H,212,260)(H,213,280)(H,214,290)(H,215,291)(H,216,283)(H,217,300)(H,218,297)(H,219,292)(H,220,288)(H,221,289)(H,222,284)(H,223,311)(H,224,307)(H,225,309)(H,226,310)(H,227,301)(H,228,285)(H,229,279)(H,230,302)(H,231,286)(H,232,304)(H,233,287)(H,234,298)(H,235,305)(H,236,308)(H,237,312)(H,238,299)(H,239,294)(H,240,313)(H,241,293)(H,242,296)(H,243,295)(H,244,303)(H,245,306)(H,261,262)(H,263,264)(H,265,266)(H,267,268)(H,269,270)(H,271,272)(H,273,274)(H,275,276)(H,277,278)(H,316,317)/t96-,97-,98-,99-,100+,101+,102+,103+,104+,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-,151-,152-,153-,154-,155-,156-,157-/m0/s1

InChIKey

WMWQLAQXXNQPGF-NNUQXLMXSA-N

Smiles

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)O)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]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N3CCC[C@H]3C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)CC)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](CCCCN)C(=O)N[C@@H](CCC(=O)N)C(=O)O