O-odn-rev

Structural Information

Molecular Formula

C₁₉₁H₂₅₀N₅₈O₁₂₈P₂₀

SMILES

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

InChI

InChI=1S/C191H250N58O128P20/c1-79-47-239(184(270)222-163(79)251)136-27-87(250)107(339-136)55-320-379(281,282)375-104-44-153(247-76-206-156-159(201)204-75-205-160(156)247)356-124(104)72-336-387(297,298)366-95-35-144(237-25-16-134(199)216-182(237)268)341-110(95)58-322-382(287,288)361-90-30-139(232-20-11-129(194)211-177(232)263)347-116(90)64-328-397(317,318)377-106-46-155(249-78-208-158-162(249)219-174(203)221-172(158)260)358-126(106)74-338-395(313,314)374-103-43-152(246-54-86(8)170(258)229-191(246)277)353-121(103)69-333-383(289,290)362-91-31-140(233-21-12-130(195)212-178(233)264)340-109(91)57-321-380(283,284)359-88-28-137(230-18-9-127(192)209-175(230)261)345-114(88)62-326-391(305,306)370-99-39-148(242-50-82(4)166(254)225-187(242)273)354-122(99)70-334-393(309,310)372-101-41-150(244-52-84(6)168(256)227-189(244)275)351-119(101)67-331-385(293,294)364-93-33-142(235-23-14-132(197)214-180(235)266)346-115(93)63-327-392(307,308)371-100-40-149(243-51-83(5)167(255)226-188(243)274)355-123(100)71-335-394(311,312)373-102-42-151(245-53-85(7)169(257)228-190(245)276)352-120(102)68-332-386(295,296)365-94-34-143(236-24-15-133(198)215-181(236)267)348-117(94)65-329-396(315,316)376-105-45-154(248-77-207-157-161(248)218-173(202)220-171(157)259)357-125(105)73-337-388(299,300)367-96-36-145(238-26-17-135(200)217-183(238)269)342-111(96)59-323-381(285,286)360-89-29-138(231-19-10-128(193)210-176(231)262)344-113(89)61-325-390(303,304)369-98-38-147(241-49-81(3)165(253)224-186(241)272)350-118(98)66-330-384(291,292)363-92-32-141(234-22-13-131(196)213-179(234)265)343-112(92)60-324-389(301,302)368-97-37-146(349-108(97)56-319-378(278,279)280)240-48-80(2)164(252)223-185(240)271/h9-26,47-54,75-78,87-126,136-155,250H,27-46,55-74H2,1-8H3,(H,281,282)(H,283,284)(H,285,286)(H,287,288)(H,289,290)(H,291,292)(H,293,294)(H,295,296)(H,297,298)(H,299,300)(H,301,302)(H,303,304)(H,305,306)(H,307,308)(H,309,310)(H,311,312)(H,313,314)(H,315,316)(H,317,318)(H2,192,209,261)(H2,193,210,262)(H2,194,211,263)(H2,195,212,264)(H2,196,213,265)(H2,197,214,266)(H2,198,215,267)(H2,199,216,268)(H2,200,217,269)(H2,201,204,205)(H,222,251,270)(H,223,252,271)(H,224,253,272)(H,225,254,273)(H,226,255,274)(H,227,256,275)(H,228,257,276)(H,229,258,277)(H2,278,279,280)(H3,202,218,220,259)(H3,203,219,221,260)

InChIKey

XQJLWSKMVFOVIM-UHFFFAOYSA-N

Compound name

[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[hydroxy-[5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-(phosphonooxymethyl)oxolan-3-yl]oxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [5-(4-amino-2-oxopyrimidin-1-yl)-3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-[[5-(6-aminopurin-9-yl)-3-[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methyl hydrogen phosphate

Related CIDs

• CID 16197669