CID 16186154
S-dc18
Structural Information
- Molecular Formula
- C162H217N54O89P17S17
- SMILES
- C1C(C(OC1N2C=CC(=NC2=O)N)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(=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(OC1CO)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)S)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)O
- InChI
- InChI=1S/C162H217N54O89P17S17/c163-109-1-19-199(145(219)181-109)127-37-73(218)92(272-127)56-254-306(237,323)290-75-39-129(201-21-3-111(165)183-147(201)221)274-94(75)58-256-308(239,325)292-77-41-131(203-23-5-113(167)185-149(203)223)276-96(77)60-258-310(241,327)294-79-43-133(205-25-7-115(169)187-151(205)225)278-98(79)62-260-312(243,329)296-81-45-135(207-27-9-117(171)189-153(207)227)280-100(81)64-262-314(245,331)298-83-47-137(209-29-11-119(173)191-155(209)229)282-102(83)66-264-316(247,333)300-85-49-139(211-31-13-121(175)193-157(211)231)284-104(85)68-266-318(249,335)302-87-51-141(213-33-15-123(177)195-159(213)233)286-106(87)70-268-320(251,337)304-89-53-143(215-35-17-125(179)197-161(215)235)288-108(89)72-270-322(253,339)305-90-54-144(216-36-18-126(180)198-162(216)236)287-107(90)71-269-321(252,338)303-88-52-142(214-34-16-124(178)196-160(214)234)285-105(88)69-267-319(250,336)301-86-50-140(212-32-14-122(176)194-158(212)232)283-103(86)67-265-317(248,334)299-84-48-138(210-30-12-120(174)192-156(210)230)281-101(84)65-263-315(246,332)297-82-46-136(208-28-10-118(172)190-154(208)228)279-99(82)63-261-313(244,330)295-80-44-134(206-26-8-116(170)188-152(206)226)277-97(80)61-259-311(242,328)293-78-42-132(204-24-6-114(168)186-150(204)224)275-95(78)59-257-309(240,326)291-76-40-130(202-22-4-112(166)184-148(202)222)273-93(76)57-255-307(238,324)289-74-38-128(271-91(74)55-217)200-20-2-110(164)182-146(200)220/h1-36,73-108,127-144,217-218H,37-72H2,(H,237,323)(H,238,324)(H,239,325)(H,240,326)(H,241,327)(H,242,328)(H,243,329)(H,244,330)(H,245,331)(H,246,332)(H,247,333)(H,248,334)(H,249,335)(H,250,336)(H,251,337)(H,252,338)(H,253,339)(H2,163,181,219)(H2,164,182,220)(H2,165,183,221)(H2,166,184,222)(H2,167,185,223)(H2,168,186,224)(H2,169,187,225)(H2,170,188,226)(H2,171,189,227)(H2,172,190,228)(H2,173,191,229)(H2,174,192,230)(H2,175,193,231)(H2,176,194,232)(H2,177,195,233)(H2,178,196,234)(H2,179,197,235)(H2,180,198,236)
- InChIKey
- LZOBNOQTDJKSMD-UHFFFAOYSA-N
- Compound name
- 4-amino-1-[5-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[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-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-sulfanylphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-2-yl]pyrimidin-2-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 5413.4980 | 311.6 |
[M+Na]+ | 5435.4799 | 311.6 |
[M-H]- | 5411.4834 | 311.6 |
[M+NH4]+ | 5430.5245 | 311.6 |
[M+K]+ | 5451.4539 | 311.6 |
[M+H-H2O]+ | 5395.4880 | 311.6 |
[M+HCOO]- | 5457.4889 | 311.6 |
[M+CH3COO]- | 5471.5046 | 311.6 |
[M+Na-2H]- | 5433.4654 | 311.6 |
[M]+ | 5412.4902 | 311.6 |
[M]- | 5412.4912 | 311.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.