N-odn-2

Structural Information

Molecular Formula

C₁₃₇H₁₇₀N₆₄O₈₀P₁₄

SMILES

C1C(C(OC1N2C=NC3=C(N=CN=C32)N)COP(=O)(O)OC4CC(OC4COP(=O)(O)OC5CC(OC5COP(=O)(O)OC6CC(OC6COP(=O)(O)OC7CC(OC7COP(=O)(O)OC8CC(OC8COP(=O)(O)OC9CC(OC9COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)O)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=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=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C137H170N64O80P14/c138-79-1-4-188(135(209)173-79)83-8-52(67(256-83)23-243-288(225,226)274-57-12-87(193-42-164-98-109(143)154-37-159-114(98)193)262-72(57)28-248-295(239,240)281-64-20-95(201-50-172-106-122(201)181-134(151)187-128(106)208)268-78(64)34-254-292(233,234)277-59-14-89(195-44-166-100-111(145)156-39-161-116(100)195)263-73(59)29-249-294(237,238)280-63-19-94(200-49-171-105-121(200)180-133(150)186-127(105)207)266-76(63)32-252-287(223,224)272-55-15-90(259-66(55)22-241-282(212,213)214)196-45-167-101-117(196)176-129(146)182-123(101)203)269-284(217,218)246-26-70-58(13-88(260-70)194-43-165-99-110(144)155-38-160-115(99)194)276-291(231,232)253-33-77-61(17-92(267-77)198-47-169-103-119(198)178-131(148)184-125(103)205)278-290(229,230)245-25-69-54(10-85(258-69)190-6-3-81(140)175-137(190)211)271-286(221,222)251-31-75-62(18-93(265-75)199-48-170-104-120(199)179-132(149)185-126(104)206)279-293(235,236)247-27-71-56(11-86(261-71)192-41-163-97-108(142)153-36-158-113(97)192)275-289(227,228)244-24-68-53(9-84(257-68)189-5-2-80(139)174-136(189)210)270-285(219,220)250-30-74-60(16-91(264-74)197-46-168-102-118(197)177-130(147)183-124(102)204)273-283(215,216)242-21-65-51(202)7-82(255-65)191-40-162-96-107(141)152-35-157-112(96)191/h1-6,35-78,82-95,202H,7-34H2,(H,215,216)(H,217,218)(H,219,220)(H,221,222)(H,223,224)(H,225,226)(H,227,228)(H,229,230)(H,231,232)(H,233,234)(H,235,236)(H,237,238)(H,239,240)(H2,138,173,209)(H2,139,174,210)(H2,140,175,211)(H2,141,152,157)(H2,142,153,158)(H2,143,154,159)(H2,144,155,160)(H2,145,156,161)(H2,212,213,214)(H3,146,176,182,203)(H3,147,177,183,204)(H3,148,178,184,205)(H3,149,179,185,206)(H3,150,180,186,207)(H3,151,181,187,208)

InChIKey

GPNRAZNBJJYZAN-UHFFFAOYSA-N

Compound name

[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[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-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-(phosphonooxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(6-aminopurin-9-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate

Related CIDs

• CID 16197475