S-anti-g/p-3

Structural Information

Molecular Formula

C₂₇₄H₃₄₆N₁₀₁O₁₄₂P₂₇S₂₇

SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)OP(=S)(O)OC[C@@H]3[C@H](C[C@@H](O3)N4C=NC5=C4N=C(NC5=O)N)OP(=S)(O)OC[C@@H]6[C@H](C[C@@H](O6)N7C=NC8=C7N=C(NC8=O)N)OP(=S)(O)OC[C@@H]9[C@H](C[C@@H](O9)N1C=CC(=NC1=O)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=CC(=NC1=O)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=CC(=NC1=O)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=CC(=NC1=O)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=CC(=NC1=O)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OC[C@@H]1[C@H](C[C@@H](O1)N1C=CC(=NC1=O)N)O)S

InChI

InChI=1S/C274H346N101O142P27S27/c1-106-50-354(266(400)339-237(106)378)183-23-116(143(59-376)463-183)491-519(410,546)437-80-164-136(43-198(484-164)369-99-312-211-230(369)325-253(287)332-246(211)387)514-543(434,570)461-85-169-138(45-200(489-169)371-101-314-213-232(371)327-255(289)334-248(213)389)512-533(424,560)442-65-149-121(28-182(469-149)353-21-15-176(280)324-265(353)399)496-524(415,551)444-68-152-124(31-186(472-152)357-53-109(4)240(381)342-269(357)403)499-526(417,553)439-62-146-118(25-179(466-146)350-18-12-173(277)321-262(350)396)493-521(412,548)447-71-155-129(36-191(475-155)362-58-114(9)245(386)347-274(362)408)504-531(422,558)459-83-167-141(48-203(487-167)374-104-317-216-235(374)330-258(292)337-251(216)392)517-544(435,571)462-86-170-139(46-201(490-170)372-102-315-214-233(372)328-256(290)335-249(214)390)513-535(426,562)450-73-157-125(32-187(477-157)358-54-110(5)241(382)343-270(358)404)500-527(418,554)440-63-147-119(26-180(467-147)351-19-13-174(278)322-263(351)397)494-522(413,549)445-69-153-127(34-189(473-153)360-56-112(7)243(384)345-272(360)406)502-529(420,556)457-81-165-137(44-199(485-165)370-100-313-212-231(370)326-254(288)333-247(212)388)511-532(423,559)441-64-148-120(27-181(468-148)352-20-14-175(279)323-264(352)398)495-523(414,550)443-67-151-123(30-185(471-151)356-52-108(3)239(380)341-268(356)402)498-525(416,552)438-61-145-117(24-178(465-145)349-17-11-172(276)320-261(349)395)492-520(411,547)446-70-154-128(35-190(474-154)361-57-113(8)244(385)346-273(361)407)503-530(421,557)458-82-166-140(47-202(486-166)373-103-316-215-234(373)329-257(291)336-250(215)391)515-541(432,568)455-78-162-133(40-195(482-162)366-96-309-208-221(284)297-90-303-227(208)366)509-539(430,566)454-77-161-135(42-197(481-161)368-98-311-210-223(286)299-92-305-229(210)368)510-540(431,567)460-84-168-142(49-204(488-168)375-105-318-217-236(375)331-259(293)338-252(217)393)516-542(433,569)456-79-163-134(41-196(483-163)367-97-310-209-222(285)298-91-304-228(209)367)508-538(429,565)453-76-160-132(39-194(480-160)365-95-308-207-220(283)296-89-302-226(207)365)507-537(428,564)452-75-159-131(38-193(479-159)364-94-307-206-219(282)295-88-301-225(206)364)506-536(427,563)451-74-158-130(37-192(478-158)363-93-306-205-218(281)294-87-300-224(205)363)505-534(425,561)449-72-156-126(33-188(476-156)359-55-111(6)242(383)344-271(359)405)501-528(419,555)448-66-150-122(29-184(470-150)355-51-107(2)238(379)340-267(355)401)497-518(409,545)436-60-144-115(377)22-177(464-144)348-16-10-171(275)319-260(348)394/h10-21,50-58,87-105,115-170,177-204,376-377H,22-49,59-86H2,1-9H3,(H,409,545)(H,410,546)(H,411,547)(H,412,548)(H,413,549)(H,414,550)(H,415,551)(H,416,552)(H,417,553)(H,418,554)(H,419,555)(H,420,556)(H,421,557)(H,422,558)(H,423,559)(H,424,560)(H,425,561)(H,426,562)(H,427,563)(H,428,564)(H,429,565)(H,430,566)(H,431,567)(H,432,568)(H,433,569)(H,434,570)(H,435,571)(H2,275,319,394)(H2,276,320,395)(H2,277,321,396)(H2,278,322,397)(H2,279,323,398)(H2,280,324,399)(H2,281,294,300)(H2,282,295,301)(H2,283,296,302)(H2,284,297,303)(H2,285,298,304)(H2,286,299,305)(H,339,378,400)(H,340,379,401)(H,341,380,402)(H,342,381,403)(H,343,382,404)(H,344,383,405)(H,345,384,406)(H,346,385,407)(H,347,386,408)(H3,287,325,332,387)(H3,288,326,333,388)(H3,289,327,334,389)(H3,290,328,335,390)(H3,291,329,336,391)(H3,292,330,337,392)(H3,293,331,338,393)/t115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143+,144+,145+,146+,147+,148+,149+,150+,151+,152+,153+,154+,155+,156+,157+,158+,159+,160+,161+,162+,163+,164+,165+,166+,167+,168+,169+,170+,177+,178+,179+,180+,181+,182+,183+,184+,185+,186+,187+,188+,189+,190+,191+,192+,193+,194+,195+,196+,197+,198+,199+,200+,201+,202+,203+,204+,518?,519?,520?,521?,522?,523?,524?,525?,526?,527?,528?,529?,530?,531?,532?,533?,534?,535?,536?,537?,538?,539?,540?,541?,542?,543?,544?/m0/s1

InChIKey

WODUXTDLBWEMPC-ZSEWGPKWSA-N

Compound name

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

Related CIDs

• CID 16220152