Gag-28

Structural Information

Molecular Formula

C₂₅₆H₃₃₄N₈₃O₁₄₁P₂₇S₂₇

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(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(=O)(OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)O)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)S)N1C=CC(=NC1=O)N)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=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)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=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=CC(=NC1=O)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)O

InChI

InChI=1S/C256H334N83O141P27S27/c1-107-64-327(249(365)305-223(107)341)198-52-130(469-482(375,509)402-72-142-115(340)37-183(428-142)335-102-282-210-215(271)276-99-279-218(210)335)157(443-198)87-416-488(381,515)461-122-44-190(319-29-15-175(263)293-241(319)357)435-149(122)79-410-501(394,528)474-135-57-203(332-69-112(6)228(346)310-254(332)370)449-163(135)93-422-503(396,530)476-137-59-205(334-71-114(8)230(348)312-256(334)372)448-162(137)92-421-489(382,516)460-121-43-189(318-28-14-174(262)292-240(318)356)432-146(121)76-405-484(377,511)456-117-39-185(314-24-10-170(258)288-236(314)352)430-144(117)74-403-486(379,513)458-119-41-187(316-26-12-172(260)290-238(316)354)434-148(119)78-407-497(390,524)470-131-53-199(328-65-108(2)224(342)306-250(328)366)444-158(131)88-417-490(383,517)462-123-45-191(320-30-16-176(264)294-242(320)358)436-150(123)80-408-498(391,525)471-132-54-200(329-66-109(3)225(343)307-251(329)367)445-159(132)89-418-492(385,519)464-125-47-193(322-32-18-178(266)296-244(322)360)438-152(125)82-411-502(395,529)475-136-58-204(333-70-113(7)229(347)311-255(333)371)450-164(136)94-423-507(400,534)478-139-61-207(337-104-284-212-217(273)278-101-281-220(212)337)452-166(139)96-425-494(387,521)466-127-49-195(324-34-20-180(268)298-246(324)362)433-147(127)77-406-485(378,512)457-118-40-186(315-25-11-171(259)289-237(315)353)431-145(118)75-404-487(380,514)459-120-42-188(317-27-13-173(261)291-239(317)355)440-154(120)84-413-504(397,531)477-138-60-206(336-103-283-211-216(272)277-100-280-219(211)336)451-165(138)95-424-495(388,522)467-129-51-197(326-36-22-182(270)300-248(326)364)442-156(129)86-415-506(399,533)480-141-63-209(339-106-286-214-222(339)302-234(275)304-232(214)350)454-168(141)98-427-496(389,523)468-128-50-196(325-35-21-181(269)299-247(325)363)439-153(128)83-412-500(393,527)473-134-56-202(331-68-111(5)227(345)309-253(331)369)446-160(134)90-419-491(384,518)463-124-46-192(321-31-17-177(265)295-243(321)359)437-151(124)81-409-499(392,526)472-133-55-201(330-67-110(4)226(344)308-252(330)368)447-161(133)91-420-493(386,520)465-126-48-194(323-33-19-179(267)297-245(323)361)441-155(126)85-414-505(398,532)479-140-62-208(338-105-285-213-221(338)301-233(274)303-231(213)349)453-167(140)97-426-483(376,510)455-116-38-184(313-23-9-169(257)287-235(313)351)429-143(116)73-401-481(373,374)508/h9-36,64-71,99-106,115-168,183-209,340H,37-63,72-98H2,1-8H3,(H,375,509)(H,376,510)(H,377,511)(H,378,512)(H,379,513)(H,380,514)(H,381,515)(H,382,516)(H,383,517)(H,384,518)(H,385,519)(H,386,520)(H,387,521)(H,388,522)(H,389,523)(H,390,524)(H,391,525)(H,392,526)(H,393,527)(H,394,528)(H,395,529)(H,396,530)(H,397,531)(H,398,532)(H,399,533)(H,400,534)(H2,257,287,351)(H2,258,288,352)(H2,259,289,353)(H2,260,290,354)(H2,261,291,355)(H2,262,292,356)(H2,263,293,357)(H2,264,294,358)(H2,265,295,359)(H2,266,296,360)(H2,267,297,361)(H2,268,298,362)(H2,269,299,363)(H2,270,300,364)(H2,271,276,279)(H2,272,277,280)(H2,273,278,281)(H,305,341,365)(H,306,342,366)(H,307,343,367)(H,308,344,368)(H,309,345,369)(H,310,346,370)(H,311,347,371)(H,312,348,372)(H2,373,374,508)(H3,274,301,303,349)(H3,275,302,304,350)

InChIKey

IYGDRNNNWIKNHO-UHFFFAOYSA-N

Compound name

1-[5-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[2-[[[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-(4-amino-2-oxopyrimidin-1-yl)-2-(dihydroxyphosphinothioyloxymethyl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphoryl]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]-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]-5-(4-amino-2-oxopyrimidin-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]-5-(6-aminopurin-9-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]-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-(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-(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]-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]-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]-4-[[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione

Related CIDs

• CID 16204679