![C50H60N5O10P Cítidín, N-beinsóil-5′-O-[bis(4-meatocsaifeinil)feinilmeitil]-2′-O-(2-meatocsaieitile)-5-meitil-, 3′ – [2-cianóeitile N,N-bis(1-meitileitile) fosfaramidít] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C50H60N5O10P Cítidín, N-beinsóil-5′-O- [bis(4-meatocsaifeinil)feinilmeitil]-2′-O- (2-meatocsaieitile)-5-meitil-, 3′ – [2-cianóeitile N,N-bis(1-meitileitile) fosfaramidít] (ACI) Íomhá Réadmhaoin](https://www.csnvchem.com/uploads/C50H60N5O10P-Cytidine.png)
C50H60N5O10P Cítidín, N-beinsóil-5′-O-[bis(4-meatocsaifeinil)feinilmeitil]-2′-O-(2-meatocsaieitile)-5-meitil-, 3′ – [2-cianóeitile N,N-bis(1-meitileitile) fosfaramidít] (ACI)
Uimhir Chlárúcháin CAS
163759-94-2
| Príomhairíonna Fisiceacha | Luach | Coinníoll |
| Meáchan Móilíneach | 922.01 | - |
| pKa (Tuartha) | 8.59±0.40 | Teocht is Aigéadaí: 25 °C |
GÁIRÍ CHANÓNACHA
N#CCCOP(OC1C(OC(N2C=C(C(= NC2=O)NC(=O)C=3C=CC=CC3)C)C1OCCOC)COC(C=4C=CC=CC4)(C5=CC=C(OC)C=C5)C6=CC=C(OC)C=C 6)N(C(C)C)C(C)C
Gáirí Isiméireacha
C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OCCOC)[C@@H](O1)N2C(=O)N=C(NC(=O)C3=CC=CC=C3)C(C)=C2)(C4=CC =C(OC)C=C4)(C5=CC=C(OC)C=C5)C6=CC=CC=C6
InChI
InChI= 1S/C50H60N5O10P/c1-34(2)55(35(3)4)66(63-29-15-28-51)65-44-43(33-62-50(38-18-13-10-14-19-38,39-20-24-41(59-7)25-21-39 )40-22-26-42(60-8)27-23-40)64-48(45(44)61-31-30-58-6)54-32-36(5)46(53-49(54)57)52-47(56)37-16-11-9-12-17-37/u9-14,16-27,32,34- 35,43-45,48U,15,29-31,33U2,1-8U3,(U,52,53,56,57)/t43-,44-,45-,48-,66?/m1/s1
Eochair InChI
FLIGVMLIIDVDSN-GICDFOIUSA-N
26 Ainm Eile don tSubstaint seo
Cítidín,N-beinsóil-5′ -O- [bis(4-meatocsaifeinil)feinilmeitil]-2′ -O-(2-meatocsaeitile)-5-meitil-, 3′-[2-cianóeitile bis(1-meitileitile) fosfaramidít] (9CI); 12: Uimhir aitheantais: WO03084478 LEATHANACH: 57 DNA éilithe; 14: Uimhir aitheantais: US20030170636 LEATHANACH: 17 DNA éilithe; 15: Uimhir aitheantais: U
S20030211606 LEATHANACH: 19 ADN éilithe; 15: PN: US20030212017 LEATHANACH: 19 ADN éilithe; 16: PN: US20040005569 LEATHANACH: 22 ADN éilithe; 17: PN: US20040006030 LEATHANACH: 23 ADN éilithe; 17: PN: US20040014049 LEATHANACH: 20 ADN éilithe; 18: PN: US20040014047 LEATHANACH E: 20 ADN éilithe; 18: PN: US20040014048 LEATHANACH: 20 ADN éilithe; 18: PN: US20040014050 LEATHANACH: 20 ADN éilithe; 19: PN: U
S20030171313 LEATHANACH: 9 ADN éilithe; 19: PN: US20030198965 LEATHANACH: 20 ADN éilithe; 19: PN: US20040005565 LEATHANACH: 17- 22 ADN éilithe; 19: PN: US20040005570 LEATHANACH: 20 ADN éilithe; 19: PN: US20040014051 LEATHANACH: 22 ADN éilithe; 20: PN: US20040014699 LCH
E: 20 ADN éilithe; 21: Uimhir PN: US20040006029 LEATHANACH: 23 ADN éilithe; 21: Uimhir PN: WO03106645 LEATHANACH: 72 ADN éilithe; 61: Uimhir PN: US20030
166592 LEATHANACH: 15 ADN éilithe; 7: Uimhir PN: WO2005006958 LEATHANACH: 62 ADN éilithe; 84: Uimhir PN: US20040171566 LEATHANACH: 18 ADN éilithe; 92:
Uimhir PN: US20040005707 LEATHANACH: 20 ADN éilithe; 9: Uimhir PN: WO2005007825 LEATHANACH: 62 ADN éilithe;N4-Beinsóil-2′ -O-meatocsaeitile-5-O- démheitocsatrítil-5-meitilcítidín-3′-fosfaramidít;N4-Beinsóil-2′ -O-meatocsaeitile-5′ -O-démheitiocsótrítil-5-meitilcítídín-3′-aimídít
Speictrim atá ar fáil
13C NMR
NMR heitreató
Maoine atá ar fáil
Bitheolaíoch
Ceimiceach
Lipinski
Struchtúr Gaolmhar
| Maoin | Luach | Coinníoll | Foinse |
| Fachtóir Bith-thiúchana | 171 | pH 1; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1250 | pH 2; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 47600 | pH 3; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 6.44 x 105 | pH 4; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1.00 x 106 | pH 5; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1.00 x 106 | pH 6; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1.00 x 106 | pH 7; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 7.79 x 105 | pH 8; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 1.63 x 105 | pH 9; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 30800 | pH 10; Teocht: 25 °C | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Maoin | Luach | Coinníoll | Foinse |
| Koc | 106 | pH 1; Teocht: 25 °C | (1) ACD |
| Koc | 773 | pH 2; Teocht: 25 °C | (1) ACD |
| Koc | 29500 | pH 3; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Koc | 3.99 x 105 | pH 4; Teocht: 25 °C | (1) ACD |
| Koc | 8.02 x 105 | pH 5; Teocht: 25 °C | (1) ACD |
| Koc | 8.70 x 105 | pH 6; Teocht: 25 °C | (1) ACD |
| Koc | 8.16 x 105 | pH 7; Teocht: 25 °C | (1) ACD |
| Koc | 4.83 x 105 | pH 8; Teocht: 25 °C | (1) ACD |
| Koc | 1.01 x 105 | pH 9; Teocht: 25 °C | (1) ACD |
| Koc | 19100 | pH 10; Teocht: 25 °C | (1) ACD |
| logD | 4.48 | pH 1; Teocht: 25 °C | (1) ACD |
| logD | 5.34 | pH 2; Teocht: 25 °C | (1) ACD |
| logD | 6.92 | pH 3; Teocht: 25 °C | (1) ACD |
| logD | 8.06 | pH 4; Teocht: 25 °C | (1) ACD |
| logD | 8.36 | pH 5; Teocht: 25 °C | (1) ACD |
| logD | 8.39 | pH 6; Teocht: 25 °C | (1) ACD |
| logD | 8.37 | pH 7; Teocht: 25 °C | (1) ACD |
| logD | 8.14 | pH 8; Teocht: 25 °C | (1) ACD |
| logD | 7.46 | pH 9; Teocht: 25 °C | (1) ACD |
| logD | 6.73 | pH 10; Teocht: 25 °C | (1) ACD |
| logP | 8.401±0.723 | Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Intreach Mais | 1.4 x 10-4 g/L | Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.1 g/L | pH 1; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 0.16 g/L | pH 2; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 4.1 x 10-3 g/L | pH 3; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 3.0 x 10-4 g/L | pH 4; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.5 x 10-4 g/L | pH 5; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.4 x 10-4 g/L | pH 6; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.5 x 10-4 g/L | pH 7; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 2.5 x 10-4 g/L | pH 8; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.2 x 10-3 g/L | pH 9; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 6.3 x 10-3 g/L | pH 10; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.5 x 10-4 g/L | Uisce Gan Maolán pH 6.97; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Intreach Mhólar | 1.5 x 10-7 móil/L | Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 1.2 x 10-3 móil/L | pH 1; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Intuaslagthacht Mhólar | 1.7 x 10-4 móil/L | pH 2; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 4.4 x 10-6 móil/L | pH 3; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 3.2 x 10-7 móil/L | pH 4; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 1.6 x 10-7 móil/L | pH 5; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 1.5 x 10-7 móil/L | pH 6; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 1.6 x 10-7 móil/L | pH 7; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.7 x 10-7 móil/L | pH 8; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 1.3 x 10-6 móil/L | pH 9; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 6.8 x 10-6 móil/L | pH 10; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 1.6 x 10-7 móil/L | Uisce Gan Maolán pH 6.97; Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 922.01 | ||
| pKa | 8.59±0.40 | Teocht is Aigéadaí: 25 °C | (1) ACD |
| pKa | 3.87±0.20 | Teocht is Bunúsaí: 25 °C | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Maoin | Luach | Coinníoll | Foinse |
| Bannaí Rothlach Saor in Aisce | 22 | (1) ACD | |
| Glacadóirí H | 15 | (1) ACD | |
| Deontóirí H | 1 | (1) ACD | |
| Suim an Deontóra/Glacadóra H | 16 | (1) ACD | |
| logP | 8.401±0.723 | Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 922.01 |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Maoin | Luach | Foinse Coinníoll |
| Achar Dromchla Polach | 176 A2 | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Speictrim atá ar fáil
1H NMR
13C NMR
![C42H52N5O9P Cítidín, N-aicéitil-5′-O-[bis(4-meatocsaifeinil)feinilmeitil]-2′-O-meitil-, 3′-[2-cianóeitile N,N-bis(1-meitileitile)fosfaraimídít] (ACI)](https://www.csnvchem.com/uploads/C42H52N5O9P-Cytidine-300x300.png)
![C41H49FN5O8P Cítidín, N-aicéitil-5′-O-[bis(4-meatocsaifeinil)feinilmeitil]-2′ – dí-ocsai-2′-fluar-, 3′ – [2-cianóeitile N,N-bis(1-meitileitile)fosfaraimídít] (ACI)](https://www.csnvchem.com/uploads/C41H49FN5O8P-Cytidine-300x300.png)
![C45H56N7O9P Guanóisín, 5′-O-[bis(4-meatocsaifeinil)feinilmeitil]-2′-O-meitil-N-(2-meitil-1-ocsapróipil)-, 3′-[2-cianóeitile N,N-bis(1-meitileitile) fosfaramidít] (ACI)](https://www.csnvchem.com/uploads/C45H56N7O9P-300x300.png)
![C44H53FN7O8 Guanóisín, 5′-O-[bis(4-meatocsafheinil)feinilmeitil]-2′-dé-ocsai-2′ – fluair-N-(2-meitil-1-ocsapróipil)-, 3′ – [2-cianóeitile N,N-bis(1-meitile eitile)fosfaraimídít] (ACI)](https://www.csnvchem.com/uploads/C44H53FN7O8-300x300.png)
![C47H51FN7O7P Adenosine, N-beinsóil-5′-O-[bis(4-meatocsaifeinil)feinilmeitil]-2′–deocsai-2′-fluar-, 3′–[2-cianó-eitile N,N-bis(1-meitileitile)fosfar-aimídít] (ACI)](https://www.csnvchem.com/uploads/C47H51FN7O7P-Adenosine-300x300.png)
![C47H60N7O10P Guanóisín, 5′-O-[bis(4-meatocsafheinil)feinilmeitil]-2′-O-(2-meatocsaitil)-N-(2-meitil-1-ocsapróipil)-, 3′-[2-cianóeitile N,N-bis(1-meitileitile)fosfaraimídít] (ACI)](https://www.csnvchem.com/uploads/C47H60N7O10P-Guanosine-300x300.png)