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Substance Name: Aprinocarsen [INN]
RN: 151879-73-1
UNII: FMT95051CQ
InChIKey: NMYKBZSMOUFOJV-FJSWQEPZSA-N

Notes

  • 20-nucleotide phosphorothioate antisense molecule that targets protein kinase C-alpha isoenzyme.
  • A PKC-alpha inhibitor.

Molecular Formulas

  • C196-H230-N68-Na19-O105-P19-S19
  • Unspecified

Molecular Weight

  • 6435.2541
 

Classification Codes

  • Antisense Oligonucleotide
  • Drug / Therapeutic Agent
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Names and Synonyms

Results Name

  • Aprinocarsen [INN]

Name of Substance

  • Aprinocarsen [INN]
  • ISIS 3521

Synonyms

  • Affinitak
  • Aprinocarsen
  • ISIS 3521
  • LY 900003
  • LY900003
  • PKC-alpha
  • UNII-FMT95051CQ

Systematic Names

  • Deoxyribonucleic acid, d(P-thio)(A-C-T-T-T-G-A-G-T-G-G-T-C-G-C-T-C-T-T-G)
  • Guanosine, 2'-deoxy-P-thioadenylyl-(5'-3')-2'-deoxy-P-thiocytidylyl-(5'-3')-P-thiothymidylyl-(5'-3')-P-thiothymidylyl-(5'-3')-P-thiothymidylyl(5'-3')-2'-deoxy-P-thioguanylyl-(5'-3')-2'-deoxy-P-thioadenylyl-(5'-3')-2'-deoxy-P-thioguanylyl-(5'-3')-P-thiothymidylyl-(5'-3')-2'-deoxy-P-thioguanylyl-(5'-3')-2'-deoxy-P-thioguanylyl-(5'-3')-P-thiothymidylyl-(5'-3')-2'-deoxy-P-thiocytidylyl-(5'-3')-2'-deoxy-P-thioguanylyl-(5'-3')-2'-deoxy-P-thiocytidylyl-(5'-3')-P-thiothymidylyl-(5'-3')-2'-deoxy-P-thiocytidylyl-(5'-3')-P-thiothymidylyl-(5'-3')-P-thiothymidylyl-(5'-3')-2'-deoxy-

Registry Numbers

CAS Registry Number

  • 151879-73-1

FDA UNII

  • FMT95051CQ

System Generated Number

  • 0151879731

Structure Descriptors

InChI

1S/C196H249N68O105P19S19/c1-75-37-249(189(285)237-165(75)267)132-23-89(109(337-132)51-313-371(294,390)351-84-18-141(331-103(84)45-265)259-69-215-149-159(259)225-179(203)231-173(149)275)359-378(301,397)320-54-112-92(26-135(340-112)252-40-78(4)168(270)240-192(252)288)358-377(300,396)315-48-106-86(20-129(334-106)246-14-10-124(198)222-186(246)282)353-372(295,391)318-52-110-90(24-133(338-110)250-38-76(2)166(268)238-190(250)286)356-376(299,395)316-49-107-88(22-131(335-107)248-16-12-126(200)224-188(248)284)355-374(297,393)326-60-118-98(32-142(346-118)260-70-216-150-160(260)226-180(204)232-174(150)276)365-383(306,402)317-50-108-87(21-130(336-108)247-15-11-125(199)223-187(247)283)354-373(296,392)319-53-111-95(29-138(339-111)255-43-81(7)171(273)243-195(255)291)362-381(304,400)328-62-120-102(36-146(348-120)264-74-220-154-164(264)230-184(208)236-178(154)280)369-388(311,407)330-64-122-100(34-144(350-122)262-72-218-152-162(262)228-182(206)234-176(152)278)367-385(308,404)324-58-116-96(30-139(344-116)256-44-82(8)172(274)244-196(256)292)363-382(305,401)327-61-119-101(35-145(347-119)263-73-219-153-163(263)229-183(207)235-177(153)279)368-387(310,406)325-59-117-97(31-140(345-117)258-68-214-148-156(202)210-66-212-158(148)258)364-386(309,405)329-63-121-99(33-143(349-121)261-71-217-151-161(261)227-181(205)233-175(151)277)366-384(307,403)323-57-115-94(28-137(343-115)254-42-80(6)170(272)242-194(254)290)361-380(303,399)322-56-114-93(27-136(342-114)253-41-79(5)169(271)241-193(253)289)360-379(302,398)321-55-113-91(25-134(341-113)251-39-77(3)167(269)239-191(251)287)357-375(298,394)314-47-105-85(19-128(333-105)245-13-9-123(197)221-185(245)281)352-370(293,389)312-46-104-83(266)17-127(332-104)257-67-213-147-155(201)209-65-211-157(147)257/h9-16,37-44,65-74,83-122,127-146,265-266H,17-36,45-64H2,1-8H3,(H,293,389)(H,294,390)(H,295,391)(H,296,392)(H,297,393)(H,298,394)(H,299,395)(H,300,396)(H,301,397)(H,302,398)(H,303,399)(H,304,400)(H,305,401)(H,306,402)(H,307,403)(H,308,404)(H,309,405)(H,310,406)(H,311,407)(H2,197,221,281)(H2,198,222,282)(H2,199,223,283)(H2,200,224,284)(H2,201,209,211)(H2,202,210,212)(H,237,267,285)(H,238,268,286)(H,239,269,287)(H,240,270,288)(H,241,271,289)(H,242,272,290)(H,243,273,291)(H,244,274,292)(H3,203,225,231,275)(H3,204,226,232,276)(H3,205,227,233,277)(H3,206,228,234,278)(H3,207,229,235,279)(H3,208,230,236,280)/t83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103+,104+,105+,106+,107+,108+,109+,110+,111+,112+,113+,114+,115+,116+,117+,118+,119+,120+,121+,122+,127+,128+,129+,130+,131+,132+,133+,134+,135+,136+,137+,138+,139+,140+,141+,142+,143+,144+,145+,146+,370?,371?,372?,373?,374?,375?,376?,377?,378?,379?,380?,381?,382?,383?,384?,385?,386?,387?,388?/m0/s1

InChIKey

NMYKBZSMOUFOJV-FJSWQEPZSA-N

Smiles

CC1=CN([C@H]2C[C@H](OP(=O)(S)OC[C@H]3O[C@H](C[C@@H]3OP(=O)(S)OC[C@H]4O[C@H](C[C@@H]4OP(=O)(S)OC[C@H]5O[C@H](C[C@@H]5O)n6cnc7c(N)ncnc67)N8C=CC(=NC8=O)N)N9C=C(C)C(=O)NC9=O)[C@@H](COP(=O)(S)O[C@H]%10C[C@@H](O[C@@H]%10COP(=O)(S)O[C@H]%11C[C@@H](O[C@@H]%11COP(=O)(S)O[C@H]%12C[C@@H](O[C@@H]%12COP(=O)(S)O[C@H]%13C[C@@H](O[C@@H]%13COP(=O)(S)O[C@H]%14C[C@@H](O[C@@H]%14COP(=O)(S)O[C@H]%15C[C@@H](O[C@@H]%15COP(=O)(S)O[C@H]%16C[C@@H](O[C@@H]%16COP(=O)(S)O[C@H]%17C[C@@H](O[C@@H]%17COP(=O)(S)O[C@H]%18C[C@@H](O[C@@H]%18COP(=O)(S)O[C@H]%19C[C@@H](O[C@@H]%19COP(=O)(S)O[C@H]%20C[C@@H](O[C@@H]%20COP(=O)(S)O[C@H]%21C[C@@H](O[C@@H]%21COP(=O)(S)O[C@H]%22C[C@@H](O[C@@H]%22COP(=O)(S)O[C@H]%23C[C@@H](O[C@@H]%23COP(=O)(S)O[C@H]%24C[C@@H](O[C@@H]%24COP(=O)(S)O[C@H]%25C[C@@H](O[C@@H]%25CO)n%26cnc%27C(=O)NC(=Nc%26%27)N)N%28C=C(C)C(=O)NC%28=O)N%29C=C(C)C(=O)NC%29=O)N%30C=CC(=NC%30=O)N)N%31C=C(C)C(=O)NC%31=O)N%32C=CC(=NC%32=O)N)n%33cnc%34C(=O)NC(=Nc%33%34)N)N%35C=CC(=NC%35=O)N)N%36C=C(C)C(=O)NC%36=O)n%37cnc%38C(=O)NC(=Nc%37%38)N)n%39cnc%40C(=O)NC(=Nc%39%40)N)N%41C=C(C)C(=O)NC%41=O)n%42cnc%43C(=O)NC(=Nc%42%43)N)n%44cnc%45c(N)ncnc%44%45)n%46cnc%47C(=O)NC(=Nc%46%47)N)N%48C=C(C)C(=O)NC%48=O)O2)C(=O)NC1=O