Ul37anti-b

Structural Information

Molecular Formula

C₁₉₄H₂₄₆N₇₃O₁₀₀P₁₉S₁₉

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(OC1CO)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)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)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(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/C194H246N73O100P19S19/c1-76-38-254(190(286)243-169(76)270)134-26-89(109(337-134)51-317-374(297,393)355-88-25-133(253-17-11-126(200)232-189(253)285)336-108(88)50-316-382(305,401)364-97-34-143(264-72-223-152-165(264)234-180(206)239-175(152)276)345-117(97)59-324-378(301,397)358-90-27-135(255-39-77(2)170(271)244-191(255)287)338-110(90)52-318-373(296,392)353-86-23-131(251-15-9-124(198)230-187(251)283)334-106(86)48-314-372(295,391)352-85-22-130(250-14-8-123(197)229-186(250)282)333-105(85)47-313-371(294,390)351-84-21-129(249-13-7-122(196)228-185(249)281)332-104(84)46-312-370(293,389)350-83-20-128(248-12-6-121(195)227-184(248)280)331-103(83)45-311-369(292,388)349-82-19-139(329-101(82)43-268)260-68-219-148-157(202)211-64-215-161(148)260)356-376(299,395)320-54-112-92(29-137(340-112)257-41-79(4)172(273)246-193(257)289)357-377(300,396)322-56-114-94(31-140(342-114)261-69-220-149-158(203)212-65-216-162(149)261)362-381(304,400)315-49-107-87(24-132(335-107)252-16-10-125(199)231-188(252)284)354-375(298,394)319-53-111-91(28-136(339-111)256-40-78(3)171(272)245-192(256)288)359-379(302,398)326-61-119-100(37-146(347-119)267-75-226-155-168(267)237-183(209)242-178(155)279)367-386(309,405)328-62-120-98(35-144(348-120)265-73-224-153-166(265)235-181(207)240-176(153)277)365-383(306,402)321-55-113-93(30-138(341-113)258-42-80(5)173(274)247-194(258)290)360-380(303,399)325-60-118-99(36-145(346-118)266-74-225-154-167(266)236-182(208)241-177(154)278)366-385(308,404)323-57-115-95(32-141(343-115)262-70-221-150-159(204)213-66-217-163(150)262)363-384(307,403)327-58-116-96(33-142(344-116)263-71-222-151-164(263)233-179(205)238-174(151)275)361-368(291,387)310-44-102-81(269)18-127(330-102)259-67-218-147-156(201)210-63-214-160(147)259/h6-17,38-42,63-75,81-120,127-146,268-269H,18-37,43-62H2,1-5H3,(H,291,387)(H,292,388)(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)(H2,195,227,280)(H2,196,228,281)(H2,197,229,282)(H2,198,230,283)(H2,199,231,284)(H2,200,232,285)(H2,201,210,214)(H2,202,211,215)(H2,203,212,216)(H2,204,213,217)(H,243,270,286)(H,244,271,287)(H,245,272,288)(H,246,273,289)(H,247,274,290)(H3,205,233,238,275)(H3,206,234,239,276)(H3,207,235,240,277)(H3,208,236,241,278)(H3,209,237,242,279)

InChIKey

HWBCQXLVBLHGHT-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16204568