CID 16197456
Octyldecylamino-p(dt)16
Structural Information
- Molecular Formula
- C178H247N33O112P16
- SMILES
- CCCCCCCCCCCCCCCCCCNP(=O)(O)OCC1C(CC(O1)N2C=C(C(=O)NC2=O)C)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)O
- InChI
- InChI=1S/C178H247N33O112P16/c1-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-179-324(245,246)277-68-116-100(36-132(294-116)197-52-84(3)148(214)181-164(197)230)309-326(249,250)279-70-118-102(38-134(296-118)199-54-86(5)150(216)183-166(199)232)311-328(253,254)281-72-120-104(40-136(298-120)201-56-88(7)152(218)185-168(201)234)313-330(257,258)283-74-122-106(42-138(300-122)203-58-90(9)154(220)187-170(203)236)315-332(261,262)285-76-124-108(44-140(302-124)205-60-92(11)156(222)189-172(205)238)317-334(265,266)287-78-126-110(46-142(304-126)207-62-94(13)158(224)191-174(207)240)319-336(269,270)289-80-128-112(48-144(306-128)209-64-96(15)160(226)193-176(209)242)321-338(273,274)291-82-130-114(50-146(308-130)211-66-98(17)162(228)195-178(211)244)323-339(275,276)292-81-129-113(49-145(307-129)210-65-97(16)161(227)194-177(210)243)322-337(271,272)290-79-127-111(47-143(305-127)208-63-95(14)159(225)192-175(208)241)320-335(267,268)288-77-125-109(45-141(303-125)206-61-93(12)157(223)190-173(206)239)318-333(263,264)286-75-123-107(43-139(301-123)204-59-91(10)155(221)188-171(204)237)316-331(259,260)284-73-121-105(41-137(299-121)202-57-89(8)153(219)186-169(202)235)314-329(255,256)282-71-119-103(39-135(297-119)200-55-87(6)151(217)184-167(200)233)312-327(251,252)280-69-117-101(37-133(295-117)198-53-85(4)149(215)182-165(198)231)310-325(247,248)278-67-115-99(212)35-131(293-115)196-51-83(2)147(213)180-163(196)229/h51-66,99-146,212H,18-50,67-82H2,1-17H3,(H,247,248)(H,249,250)(H,251,252)(H,253,254)(H,255,256)(H,257,258)(H,259,260)(H,261,262)(H,263,264)(H,265,266)(H,267,268)(H,269,270)(H,271,272)(H,273,274)(H,275,276)(H2,179,245,246)(H,180,213,229)(H,181,214,230)(H,182,215,231)(H,183,216,232)(H,184,217,233)(H,185,218,234)(H,186,219,235)(H,187,220,236)(H,188,221,237)(H,189,222,238)(H,190,223,239)(H,191,224,240)(H,192,225,241)(H,193,226,242)(H,194,227,243)(H,195,228,244)
- InChIKey
- QQMRMHUYSVJXDM-UHFFFAOYSA-N
- Compound name
- [3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-N-octadecylphosphonamidic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 5135.0523 | 314.8 |
[M+Na]+ | 5157.0342 | 315.0 |
[M-H]- | 5133.0377 | 314.9 |
[M+NH4]+ | 5152.0788 | 314.8 |
[M+K]+ | 5173.0082 | 314.7 |
[M+H-H2O]+ | 5117.0423 | 314.4 |
[M+HCOO]- | 5179.0432 | 314.7 |
[M+CH3COO]- | 5193.0589 | 314.6 |
[M+Na-2H]- | 5155.0197 | 314.8 |
[M]+ | 5134.0445 | 314.9 |
[M]- | 5134.0455 | 314.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.