C47H60n7o10p Guanosine, 5 '-wempopyl] - (2-methyothyl) - (2-methyleyl) -n- (ACI)
Àireamh Clàrs Cas
251647-55-5-9
H302
Prìomh thogalaichean corporra | Luach | Suidheachadh |
Cuideam molecular | 914.00 | - |
paka (ro-innse) | 9.16 ± 0.20 | Temp as searbhagach: 25 ° C. |
Smiles Canonical
N # cccop (OC1C (OC (OC (N2C = NC = 3c (^ = cc = c (cc = c (c (c (c (c) c (c) c (c) c (c) c.
Gàire isomicic
C (OC [C @@] 1 [c @@] (C (C (C (C (C (C (C (C (C. = cc = c (OC) C = C4) (C4 = CC = C (OC) C = c5) C6 = cc = cc = cc = cc = cc = cc = cc = c
Inchi
Inchi = 1s / c47H60n7o10P / C1-30 (25-23-53 (64-25-13-248-48) 54 ( 31 (3) 4) 32 (5) 6) 38 (63-45) 28-6-4-37 (59-37 (59-34 (59-37 / H10-12-2,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,29-32,3-32,38 , 40-41,45-28h2,2-9h3, (H2-,52,52,5-, 41-, 6--, 65- "65? / S1
Iuchair Inchi
Lancdgnobnebynau-sBCraqivsa-n
17 ainmean eile airson an stuth seo
Guanosine, 5 '-O- [BIS (4-Neach-obrach) dha na Leumnylmeyl] -2 '-O- (2-Neach-obrach) -N- (2-methyl-1-oxopropyl) -, 3 '- [2-Cyanodethyl Bis (1- Prianoylyl) fospHoondidite] (9c); 17: PN: US20030212017 Page: 20 sreath iarrte a-steach; 18: PN: US20030211606 Duilleag: 20
sreath ag ràdh; 19: PN: US20040040040040040005569 Duilleag: 22 sreath ag ràdh; 21: PN: US20040040040006030 Duilleag: 23 sreath iarr; 21: PN: US20040040014047 Page: 21 sreath air a ràdh a-steach; 21: PN: US20040040014049 Duilleag: 21 sreath air a ràdh a-steach; 22: PN: US20030198965 PAG
E: 20 sreath iarrteil; 22: PN: US20040040040040040005570 Duilleag: 21 sreath air a ràdh a-steach; 22: PN: US20040040014048 Duilleag: 21 sreath a chaidh a ràdh;
22: PN: US2004004004050 Duilleag: 21 Seòrsa air a ràdh; 23: PN: US2004004004004004004004004000565 Duilleag: 17- b 'e an sreath dhiubh a thagradh; 23: PN: US20040
014051 Duilleag: 23 Seòrsa a chaidh a ràdh; 24: PN: US2004004004699 Duilleag: 21 sreath air a ràdh a-steach; 25: PN: US20040040040040006029 Duilleag: 23 sreath iarr; 25: PN: W0310106645 Duilleag: 73 sreath a chaidh a thagradh; 96: PN: US20040040040040005707 Duilleag: 21 Seòrsa air an tagradh
Spectra ri fhaighinn
13 c nmr
Hetero nmr
Togalaichean rim faighinn
Bith-eòlasach
Ceimigeach
Lipinski
Structar co-cheangailte
Seilbh | Luach | Suidheachadh | Stòr |
Dà fhaclan bith-eòlasach | 121 | Ph 1; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 2580 | Ph 2; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 23500 | Ph 3; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 71800 | Ph 4; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 89800 | Ph 5; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 92100 | Ph 6; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 91300 | Ph 7; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 82500 | Ph 8; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 42200 | Ph 9; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 7860 | Ph 10; Temp: 25 ° C. | (1) ACD |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Seilbh | Luach | Suidheachadh | Stòr |
Koc | 164 | Ph 1; Temp: 25 ° C. | (1) ACD |
Koc | 3480 | Ph 2; Temp: 25 ° C. | (1) ACD |
Koc | 31700 | Ph 3; Temp: 25 ° C. | (1) ACD |
Koc | 96900 | Ph 4; Temp: 25 ° C. | (1) ACD |
Koc | 1.21 x 105 | Ph 5; Temp: 25 ° C. | (1) ACD |
Seilbh | Luach | Suidheachadh | Stòr |
Koc | 1.24 x 105 | Ph 6; Temp: 25 ° C. | (1) ACD |
Koc | 1.23 x 105 | Ph 7; Temp: 25 ° C. | (1) ACD |
Koc | 1.11 x 105 | Ph 8; Temp: 25 ° C. | (1) ACD |
Koc | 56900 | Ph 9; Temp: 25 ° C. | (1) ACD |
Koc | 10600 | Ph 10; Temp: 25 ° C. | (1) ACD |
logd | 3.95 | Ph 1; Temp: 25 ° C. | (1) ACD |
logd | 5.28 | Ph 2; Temp: 25 ° C. | (1) ACD |
logd | 6.24 | Ph 3; Temp: 25 ° C. | (1) ACD |
logd | 6.73 | Ph 4; Temp: 25 ° C. | (1) ACD |
logd | 6.82 | Ph 5; Temp: 25 ° C. | (1) ACD |
logd | 6.83 | Ph 6; Temp: 25 ° C. | (1) ACD |
logd | 6.83 | Ph 7; Temp: 25 ° C. | (1) ACD |
logd | 6.79 | Ph 8; Temp: 25 ° C. | (1) ACD |
logd | 6.50 | Ph 9; Temp: 25 ° C. | (1) ACD |
logd | 5.77 | Ph 10; Temp: 25 ° C. | (1) ACD |
logp | 6.837 ± 0.764 | Temp: 25 ° C. | (1) ACD |
Misneachd solbalileachd neo-ghnèitheach mòr | 4.4 x 10-4 G / L | Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 0.34 g / l | Ph 1; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 0.016 G / L | Ph 2; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 1.7 x 10-3 G / L. | Ph 3; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 5.7 x 10-4 G / L | Ph 4; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 4.6 x 10-4 G / L | Ph 5; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 4.4 x 10-4 G / L | Ph 6; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 4.5 x 10-4 G / L | Ph 7; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 4.9 x 10-4 G / L | Ph 8; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 1.0 x 10-3 G / L. | Ph 9; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 5.2 x 10-3 G / L. | Ph 10; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 4.5 x 10-4 G / L | Uisge Unbuffered PH 6.99; Temp: 25 ° C. | (1) ACD |
Solbalileachd neo-ghnèitheach molar | 4.8 x 10-7 Mol / L. | Temp: 25 ° C. | (1) ACD |
Solubility molar | 3.7 x 10-4 Mol / L. | Ph 1; Temp: 25 ° C. | (1) ACD |
Solubility molar | 1.7 x 10-5 Mol / L. | Ph 2; Temp: 25 ° C. | (1) ACD |
Solubility molar | 1.9 x 10-6 Mol / L. | Ph 3; Temp: 25 ° C. | (1) ACD |
Seilbh | Luach | Suidheachadh | Stòr |
Solubility molar | 6.2 x 10-7 Mol / L. | Ph 4; Temp: 25 ° C. | (1) ACD |
Solubility molar | 5.0 x 10-7 Mol / L. | Ph 5; Temp: 25 ° C. | (1) ACD |
Solubility molar | 4.8 x 10-7 Mol / L. | Ph 6; Temp: 25 ° C. | (1) ACD |
Solubility molar | 4.9 x 10-7 Mol / L. | Ph 7; Temp: 25 ° C. | (1) ACD |
Solubility molar | 5.4 x 10-7 Mol / L. | Ph 8; Temp: 25 ° C. | (1) ACD |
Solubility molar | 1.1 x 10-6 Mol / L. | Ph 9; Temp: 25 ° C. | (1) ACD |
Solubility molar | 5.7 x 10-6 Mol / L. | Ph 10; Temp: 25 ° C. | (1) ACD |
Solubility molar | 4.9 x 10-7 Mol / L. | Uisge Unbuffered PH 6.99; Temp: 25 ° C. | (1) ACD |
Cuideam molecular | 914.00 | ||
paka | 9.16 ± 0.20 | Temp as searbhagach: 25 ° C. | (1) ACD |
paka | 3.45 ± 0.70 | Temp as bunaitiche: 25 ° C. | (1) ACD |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Seilbh | Luach | Suidheachadh | Stòr |
Bannan gu tur ro-bheathaichte | 22 | (1) ACD | |
Hrrairean | 17 | (1) ACD | |
Hnors her | 2 | (1) ACD | |
H tabhartaiche / geurraiche suim | 19 | (1) ACD | |
logp | 6.837 ± 0.764 | Temp: 25 ° C. | (1) ACD |
Cuideam molecular | 914.00 |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Seilbh | Luach | Stòr cumhachd |
Raon uachdar pòla | 203 A2 | (1) ACD |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Spectra ri fhaighinn
1 h nmr
13 c nmr
Còd ath-aithris cunntaraidh | |
H302 cronail ma tha thu a 'slugadh | Buidheann Ceimigeach Eòrpach (Echa) Seòrsachadh & Labeling Clàr-stuthan Cunntas-sluaigh agus Labeling - Nothan as cumanta, Buidheann Cheimigeach Eòrpach (Echa) Clàr-seilbhe & Labeling - Clàr-seilbhe fios agus bileag - A 'GABHAIL A-STEACH - A' mhòr-chuid de dh 'aithrisean as miosa |