Ul101anti-a

Structural Information

Molecular Formula

C₂₀₄H₂₅₇N₈₁O₁₀₅P₂₀S₂₀

SMILES

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

InChI

InChI=1S/C204H257N81O105P20S20/c1-77-38-271(201(306)261-175(77)288)136-25-89(378-399(318,419)335-47-107-87(23-134(355-107)269-15-9-127(209)243-199(269)304)376-397(316,417)344-58-118-99(35-147(366-118)283-74-236-158-172(283)250-192(219)258-184(158)297)389-409(328,429)348-57-117-95(31-143(365-117)279-70-232-154-168(279)246-188(215)254-180(154)293)382-391(310,411)330-43-103-81(287)17-129(351-103)275-66-228-150-161(211)222-63-225-164(150)275)110(358-136)50-338-394(313,414)373-84-20-131(266-12-6-124(206)240-196(266)301)352-104(84)44-332-393(312,413)372-83-19-130(265-11-5-123(205)239-195(265)300)353-105(83)45-333-400(319,420)379-90-26-137(272-39-78(2)176(289)262-202(272)307)360-112(90)52-340-405(324,425)383-93-29-140(276-67-229-151-162(212)223-64-226-165(151)276)362-114(93)54-342-396(315,416)375-86-22-133(268-14-8-126(208)242-198(268)303)354-106(86)46-334-401(320,421)380-91-27-138(273-40-79(3)177(290)263-203(273)308)361-113(91)53-341-406(325,426)387-98-34-146(282-73-235-157-171(282)249-191(218)257-183(157)296)370-122(98)62-349-410(329,430)390-100-36-148(284-75-237-159-173(284)251-193(220)259-185(159)298)367-119(100)59-345-398(317,418)377-88-24-135(270-16-10-128(210)244-200(270)305)357-109(88)49-337-404(323,424)386-97-33-145(281-72-234-156-170(281)248-190(217)256-182(156)295)369-121(97)61-347-407(326,427)384-94-30-141(277-68-230-152-163(213)224-65-227-166(152)277)363-115(94)55-343-408(327,428)388-101-37-149(285-76-238-160-174(285)252-194(221)260-186(160)299)368-120(101)60-346-402(321,422)381-92-28-139(274-41-80(4)178(291)264-204(274)309)359-111(92)51-339-395(314,415)374-85-21-132(267-13-7-125(207)241-197(267)302)356-108(85)48-336-403(322,423)385-96-32-144(280-71-233-155-169(280)247-189(216)255-181(155)294)364-116(96)56-331-392(311,412)371-82-18-142(350-102(82)42-286)278-69-231-153-167(278)245-187(214)253-179(153)292/h5-16,38-41,63-76,81-122,129-149,286-287H,17-37,42-62H2,1-4H3,(H,310,411)(H,311,412)(H,312,413)(H,313,414)(H,314,415)(H,315,416)(H,316,417)(H,317,418)(H,318,419)(H,319,420)(H,320,421)(H,321,422)(H,322,423)(H,323,424)(H,324,425)(H,325,426)(H,326,427)(H,327,428)(H,328,429)(H,329,430)(H2,205,239,300)(H2,206,240,301)(H2,207,241,302)(H2,208,242,303)(H2,209,243,304)(H2,210,244,305)(H2,211,222,225)(H2,212,223,226)(H2,213,224,227)(H,261,288,306)(H,262,289,307)(H,263,290,308)(H,264,291,309)(H3,214,245,253,292)(H3,215,246,254,293)(H3,216,247,255,294)(H3,217,248,256,295)(H3,218,249,257,296)(H3,219,250,258,297)(H3,220,251,259,298)(H3,221,252,260,299)

InChIKey

ORQCELXJDBROQS-UHFFFAOYSA-N

Compound name

1-[5-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-sulfanylphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione

Related CIDs

• CID 16204558