Scrambled as(lys) (106)

Structural Information

Molecular Formula

C₁₅₃H₁₉₆N₅₇O₈₁P₁₅S₁₅

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3CO)N4C=CC(=NC4=O)N)OP(=S)(O)OCC5C(CC(O5)N6C=CC(=NC6=O)N)OP(=S)(O)OCC7C(CC(O7)N8C=NC9=C8N=C(NC9=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C153H196N57O81P15S15/c1-60-34-202(151(228)192-131(60)213)109-25-70(86(268-109)44-247-293(232,308)277-64-19-103(261-79(64)37-211)196-12-5-96(155)176-145(196)222)283-299(238,314)249-40-82-68(23-107(264-82)200-16-9-100(159)180-149(200)226)281-297(236,312)256-49-91-75(30-114(273-91)207-56-171-120-127(207)183-140(163)188-135(120)217)288-303(242,318)251-42-84-66(21-105(266-84)198-14-7-98(157)178-147(198)224)279-295(234,310)253-45-87-71(26-110(269-87)203-35-61(2)132(214)193-152(203)229)284-301(240,316)260-52-94-76(31-115(276-94)208-57-172-121-128(208)184-141(164)189-136(121)218)289-304(243,319)252-43-85-69(24-108(267-85)201-17-10-101(160)181-150(201)227)282-298(237,313)258-51-93-78(33-117(275-93)210-59-174-123-130(210)186-143(166)191-138(123)220)291-306(245,321)255-47-89-73(28-112(271-89)205-54-169-118-124(161)167-53-168-125(118)205)287-302(241,317)250-41-83-65(20-104(265-83)197-13-6-97(156)177-146(197)223)278-294(233,309)248-39-81-67(22-106(263-81)199-15-8-99(158)179-148(199)225)280-296(235,311)257-50-92-77(32-116(274-92)209-58-173-122-129(209)185-142(165)190-137(122)219)290-305(244,320)254-46-88-72(27-111(270-88)204-36-62(3)133(215)194-153(204)230)285-300(239,315)259-48-90-74(29-113(272-90)206-55-170-119-126(206)182-139(162)187-134(119)216)286-292(231,307)246-38-80-63(212)18-102(262-80)195-11-4-95(154)175-144(195)221/h4-17,34-36,53-59,63-94,102-117,211-212H,18-33,37-52H2,1-3H3,(H,231,307)(H,232,308)(H,233,309)(H,234,310)(H,235,311)(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)(H2,154,175,221)(H2,155,176,222)(H2,156,177,223)(H2,157,178,224)(H2,158,179,225)(H2,159,180,226)(H2,160,181,227)(H2,161,167,168)(H,192,213,228)(H,193,214,229)(H,194,215,230)(H3,162,182,187,216)(H3,163,183,188,217)(H3,164,184,189,218)(H3,165,185,190,219)(H3,166,186,191,220)

InChIKey

ILRPXERMLASUJA-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16133942