P14m3

Structural Information

Molecular Formula

C₁₄₅H₁₉₃N₄₈O₈₅P₁₃S₁₃

SMILES

COC1C(C(OC1N2C=CC(=O)NC2=O)COP(=S)(O)OC3C(OC(C3OC)N4C=NC5=C4N=C(NC5=O)N)COP(=O)(OC6C(OC(C6OC)N7C=NC8=C(N=CN=C87)N)COP(=S)(O)OC9C(OC(C9OC)N1C=CC(=O)NC1=O)COP(=S)(O)OC1C(OC(C1OC)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1OC)N1C=NC2=C1N=C(NC2=O)N)COP(=S)(O)OC1C(OC(C1OC)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1OC)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1OC)N1C=CC(=O)NC1=O)COP(=S)(O)OC1C(OC(C1OC)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1OC)N1C=CC(=NC1=O)N)COP(=S)(O)OC1C(OC(C1OC)N1C=NC2=C1N=C(NC2=O)N)COP(=S)(O)OC1C(OC(C1OC)N1C=NC2=C(N=CN=C21)N)COP(=S)(O)OC1C(OC(C1OC)N1C=CC(=O)NC1=O)CO)S)O

InChI

InChI=1S/C145H193N48O85P13S13/c1-225-96-82(199)55(253-120(96)185-29-20-73(195)170-142(185)208)34-239-279(212,292)274-93-65(263-131(107(93)236-12)191-51-162-79-114(191)174-134(153)177-117(79)200)44-250-290(223,303)276-92-64(262-130(106(92)235-11)190-50-161-78-111(152)157-48-159-113(78)190)43-248-286(219,299)273-90-62(260-128(104(90)233-9)188-32-23-76(198)173-145(188)211)41-245-284(217,297)270-87-60(258-125(101(87)230-6)183-27-18-71(149)168-140(183)206)39-246-288(221,301)277-94-66(264-132(108(94)237-13)192-52-163-80-115(192)175-135(154)178-118(80)201)45-249-287(220,300)271-88-58(256-126(102(88)231-7)184-28-19-72(150)169-141(184)207)36-242-281(214,294)267-84-57(255-122(98(84)227-3)180-24-15-68(146)165-137(180)203)37-243-285(218,298)272-89-61(259-127(103(89)232-8)187-31-22-75(197)172-144(187)210)40-244-283(216,296)269-85-56(254-123(99(85)228-4)181-25-16-69(147)166-138(181)204)35-241-282(215,295)268-86-59(257-124(100(86)229-5)182-26-17-70(148)167-139(182)205)38-247-289(222,302)278-95-67(265-133(109(95)238-14)193-53-164-81-116(193)176-136(155)179-119(81)202)46-251-291(224,304)275-91-63(261-129(105(91)234-10)189-49-160-77-110(151)156-47-158-112(77)189)42-240-280(213,293)266-83-54(33-194)252-121(97(83)226-2)186-30-21-74(196)171-143(186)209/h15-32,47-67,82-109,120-133,194,199H,33-46H2,1-14H3,(H,212,292)(H,213,293)(H,214,294)(H,215,295)(H,216,296)(H,217,297)(H,218,298)(H,219,299)(H,220,300)(H,221,301)(H,222,302)(H,223,303)(H,224,304)(H2,146,165,203)(H2,147,166,204)(H2,148,167,205)(H2,149,168,206)(H2,150,169,207)(H2,151,156,158)(H2,152,157,159)(H,170,195,208)(H,171,196,209)(H,172,197,210)(H,173,198,211)(H3,153,174,177,200)(H3,154,175,178,201)(H3,155,176,179,202)

InChIKey

QCQYUDAPNZTJOZ-UHFFFAOYSA-N

Compound name

1-[5-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(6-aminopurin-9-yl)-2-[[[5-(2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)-4-methoxyoxolan-3-yl]oxy-sulfanylphosphoryl]oxymethyl]-4-methoxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxy-3-methoxyoxolan-2-yl]pyrimidine-2,4-dione

Related CIDs

• CID 16186187