CID 16130128
(dt)20-[rump]2
Structural Information
- Molecular Formula
- C218H283N44O154P21
- SMILES
- CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)OP(=O)(O)OCC3C(CC(O3)N4C=C(C(=O)NC4=O)C)OP(=O)(O)OCC5C(CC(O5)N6C=C(C(=O)NC6=O)C)OP(=O)(O)OCC7C(CC(O7)N8C=C(C(=O)NC8=O)C)OP(=O)(O)OCC9C(CC(O9)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(C(C(O1)N1C=CC(=O)NC1=O)O)OP(=O)(O)OCC1C(C(C(O1)N1C=CC(=O)NC1=O)O)O
- InChI
- InChI=1S/C218H283N44O154P21/c1-87-45-243(199(291)221-175(87)269)151-25-107(127(65-263)374-151)396-417(311,312)353-66-128-108(26-152(375-128)244-46-88(2)176(270)222-200(244)292)397-418(313,314)354-67-129-109(27-153(376-129)245-47-89(3)177(271)223-201(245)293)398-419(315,316)355-68-130-110(28-154(377-130)246-48-90(4)178(272)224-202(246)294)399-420(317,318)356-69-131-111(29-155(378-131)247-49-91(5)179(273)225-203(247)295)400-421(319,320)357-70-132-112(30-156(379-132)248-50-92(6)180(274)226-204(248)296)401-422(321,322)358-71-133-113(31-157(380-133)249-51-93(7)181(275)227-205(249)297)402-423(323,324)359-72-134-114(32-158(381-134)250-52-94(8)182(276)228-206(250)298)403-424(325,326)360-73-135-115(33-159(382-135)251-53-95(9)183(277)229-207(251)299)404-425(327,328)361-74-136-116(34-160(383-136)252-54-96(10)184(278)230-208(252)300)405-426(329,330)362-75-137-117(35-161(384-137)253-55-97(11)185(279)231-209(253)301)406-427(331,332)363-76-138-118(36-162(385-138)254-56-98(12)186(280)232-210(254)302)407-428(333,334)364-77-139-119(37-163(386-139)255-57-99(13)187(281)233-211(255)303)408-429(335,336)365-78-140-120(38-164(387-140)256-58-100(14)188(282)234-212(256)304)409-430(337,338)366-79-141-121(39-165(388-141)257-59-101(15)189(283)235-213(257)305)410-431(339,340)367-80-142-122(40-166(389-142)258-60-102(16)190(284)236-214(258)306)411-432(341,342)368-81-143-123(41-167(390-143)259-61-103(17)191(285)237-215(259)307)412-433(343,344)369-82-144-124(42-168(391-144)260-62-104(18)192(286)238-216(260)308)413-434(345,346)370-83-145-125(43-169(392-145)261-63-105(19)193(287)239-217(261)309)414-435(347,348)371-84-146-126(44-170(393-146)262-64-106(20)194(288)240-218(262)310)415-436(349,350)373-86-148-174(173(268)196(395-148)242-24-22-150(265)220-198(242)290)416-437(351,352)372-85-147-171(266)172(267)195(394-147)241-23-21-149(264)219-197(241)289/h21-24,45-64,107-148,151-174,195-196,263,266-268H,25-44,65-86H2,1-20H3,(H,311,312)(H,313,314)(H,315,316)(H,317,318)(H,319,320)(H,321,322)(H,323,324)(H,325,326)(H,327,328)(H,329,330)(H,331,332)(H,333,334)(H,335,336)(H,337,338)(H,339,340)(H,341,342)(H,343,344)(H,345,346)(H,347,348)(H,349,350)(H,351,352)(H,219,264,289)(H,220,265,290)(H,221,269,291)(H,222,270,292)(H,223,271,293)(H,224,272,294)(H,225,273,295)(H,226,274,296)(H,227,275,297)(H,228,276,298)(H,229,277,299)(H,230,278,300)(H,231,279,301)(H,232,280,302)(H,233,281,303)(H,234,282,304)(H,235,283,305)(H,236,284,306)(H,237,285,307)(H,238,286,308)(H,239,287,309)(H,240,288,310)
- InChIKey
- NODRDYOWMXBFIK-UHFFFAOYSA-N
- Compound name
- [5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl [5-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-[[hydroxy-[2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 6632.0229 | 311.5 |
[M+Na]+ | 6654.0048 | 311.5 |
[M-H]- | 6630.0083 | 311.5 |
[M+NH4]+ | 6649.0494 | 311.5 |
[M+K]+ | 6669.9788 | 311.5 |
[M+H-H2O]+ | 6614.0129 | 311.5 |
[M+HCOO]- | 6676.0138 | 311.5 |
[M+CH3COO]- | 6690.0295 | 311.5 |
[M+Na-2H]- | 6651.9903 | 311.5 |
[M]+ | 6631.0151 | 311.6 |
[M]- | 6631.0161 | 311.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.