Acmpa ccmpc aat tcmpt gaa aat gg

Structural Information

Molecular Formula

C₁₉₈H₂₅₁N₇₈O₁₁₁P₁₉

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(C)OC3CC(OC3COP(=O)(O)OC4CC(OC4COP(=O)(O)OC5CC(OC5COP(=O)(O)OC6CC(OC6COP(=O)(O)OC7CC(OC7COP(=O)(O)OC8CC(OC8COP(=O)(C)OC9CC(OC9COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(C)OC1CC(OC1COP(=O)(O)OC1CC(OC1CO)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C198H251N78O111P19/c1-81-38-262(195(291)253-180(81)279)136-25-92(375-396(308,309)347-61-124-104(37-149(368-124)276-80-241-160-179(276)249-189(214)252-186(160)285)387-406(328,329)346-59-122-102(35-147(366-122)273-77-238-157-168(211)222-69-230-176(157)273)386-405(326,327)345-58-121-101(34-146(365-121)272-76-237-156-167(210)221-68-229-175(156)272)385-404(324,325)344-57-120-100(33-145(364-120)271-75-236-155-166(209)220-67-228-174(155)271)384-403(322,323)343-56-119-98(31-143(363-119)269-73-234-153-164(207)218-65-226-172(153)269)382-401(318,319)340-53-116-95(28-139(359-116)265-41-84(4)183(282)256-198(265)294)378-398(312,313)348-60-123-103(36-148(367-123)275-79-240-159-178(275)248-188(213)251-185(159)284)380-391(298,299)333-43-106-85(278)18-130(350-106)274-78-239-158-177(274)247-187(212)250-184(158)283)108(356-136)45-331-389(6,296)370-89-22-133(259-15-10-127(201)244-192(259)288)354-112(89)49-336-394(304,305)376-93-26-137(263-39-82(2)181(280)254-196(263)292)357-114(93)51-338-397(310,311)377-94-27-138(264-40-83(3)182(281)255-197(264)293)358-115(94)52-339-400(316,317)381-97-30-142(268-72-233-152-163(206)217-64-225-171(152)268)362-118(97)55-342-402(320,321)383-99-32-144(270-74-235-154-165(208)219-66-227-173(154)270)361-117(99)54-341-395(306,307)373-90-23-134(260-16-11-128(202)245-193(260)289)351-107(90)44-330-388(5,295)369-88-21-132(258-14-9-126(200)243-191(258)287)353-111(88)48-335-393(302,303)374-91-24-135(261-17-12-129(203)246-194(261)290)355-113(91)50-337-399(314,315)379-96-29-141(267-71-232-151-162(205)216-63-224-170(151)267)360-109(96)46-332-390(7,297)371-87-20-131(257-13-8-125(199)242-190(257)286)352-110(87)47-334-392(300,301)372-86-19-140(349-105(86)42-277)266-70-231-150-161(204)215-62-223-169(150)266/h8-17,38-41,62-80,85-124,130-149,277-278H,18-37,42-61H2,1-7H3,(H,298,299)(H,300,301)(H,302,303)(H,304,305)(H,306,307)(H,308,309)(H,310,311)(H,312,313)(H,314,315)(H,316,317)(H,318,319)(H,320,321)(H,322,323)(H,324,325)(H,326,327)(H,328,329)(H2,199,242,286)(H2,200,243,287)(H2,201,244,288)(H2,202,245,289)(H2,203,246,290)(H2,204,215,223)(H2,205,216,224)(H2,206,217,225)(H2,207,218,226)(H2,208,219,227)(H2,209,220,228)(H2,210,221,229)(H2,211,222,230)(H,253,279,291)(H,254,280,292)(H,255,281,293)(H,256,282,294)(H3,212,247,250,283)(H3,213,248,251,284)(H3,214,249,252,285)

InChIKey

WXHWRBIFBTXAER-UHFFFAOYSA-N

Compound name

[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methyl [5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate

Related CIDs

• CID 16197258