As(val)

Structural Information

Molecular Formula

C₁₅₄H₁₉₃N₆₈O₇₄P₁₅S₁₅

SMILES

C1C(C(OC1N2C=NC3=C(N=CN=C32)N)COP(=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(OC1CO)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C154H193N68O74P15S15/c155-92-1-7-207(149(230)191-92)99-14-61(76(29-223)266-99)282-298(237,313)252-31-78-63(16-101(268-78)209-9-3-94(157)193-151(209)232)285-301(240,316)261-40-87-72(25-110(277-87)219-56-187-120-135(219)198-145(167)203-140(120)226)294-310(249,325)265-44-91-75(28-113(281-91)222-59-190-123-138(222)201-148(170)206-143(123)229)296-311(250,326)263-42-89-71(24-109(279-89)218-55-186-119-134(218)197-144(166)202-139(119)225)292-305(244,320)256-35-82-66(19-104(272-82)212-12-6-97(160)196-154(212)235)287-302(241,317)262-41-88-73(26-111(278-88)220-57-188-121-136(220)199-146(168)204-141(121)227)295-309(248,324)264-43-90-74(27-112(280-90)221-58-189-122-137(221)200-147(169)205-142(122)228)293-308(247,323)260-39-86-70(23-108(276-86)217-54-185-118-128(165)175-49-180-133(118)217)291-307(246,322)259-38-85-69(22-107(275-85)216-53-184-117-127(164)174-48-179-132(117)216)290-306(245,321)258-37-84-68(21-106(274-84)215-52-183-116-126(163)173-47-178-131(116)215)289-304(243,319)255-34-81-65(18-103(271-81)211-11-5-96(159)195-153(211)234)286-300(239,315)257-36-83-67(20-105(273-83)214-51-182-115-125(162)172-46-177-130(115)214)288-303(242,318)254-33-80-64(17-102(270-80)210-10-4-95(158)194-152(210)233)284-299(238,314)253-32-79-62(15-100(269-79)208-8-2-93(156)192-150(208)231)283-297(236,312)251-30-77-60(224)13-98(267-77)213-50-181-114-124(161)171-45-176-129(114)213/h1-12,45-91,98-113,223-224H,13-44H2,(H,236,312)(H,237,313)(H,238,314)(H,239,315)(H,240,316)(H,241,317)(H,242,318)(H,243,319)(H,244,320)(H,245,321)(H,246,322)(H,247,323)(H,248,324)(H,249,325)(H,250,326)(H2,155,191,230)(H2,156,192,231)(H2,157,193,232)(H2,158,194,233)(H2,159,195,234)(H2,160,196,235)(H2,161,171,176)(H2,162,172,177)(H2,163,173,178)(H2,164,174,179)(H2,165,175,180)(H3,166,197,202,225)(H3,167,198,203,226)(H3,168,199,204,227)(H3,169,200,205,228)(H3,170,201,206,229)

InChIKey

RZUVOHQSXSIEAD-UHFFFAOYSA-N

Compound name

2-amino-9-[4-[[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-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-[[3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-[[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-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]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-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-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-2-yl]-1H-purin-6-one

Related CIDs

• CID 16133943