C34H39N3o8 CILIILIN, 5'-O- [Bis (4-MethxyPheil) -2 -2'-O- (2-metol) -2 -.0 metilel- (9C, ACI)
| Esasy fiziki aýratynlyklary | Bahasy | Ýagdaýy |
| Molekulýar agramy | 617.69 | - |
| Gaýnadylan nokady (çak edilýär) | 762.6 ± 70.0 ° C. | MEKDEB: 760 torr |
| Dykyzlygy (çak edilýär) | 1.27 ± 0,1,1 G / CM3 | Bu bellik: 20 ° C; MEKDEB: 760 torr |
| pka (çak edilýär) | 13.31 ± 0.70 | "Kisidik temp: 25 ° C. |
Canonical SMILES O=C1N=C(N)C(=CN1C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C=C5)C(O)C2OCCOC)C
Isomik ýylgyrýar c (ok [h] 1o [c @ h] (c @ = cc) n = c @ = cc = c f / c f = c f = c f = c f = c f = c f = c f = c f = c f = c f = c f = cc = c f = cc = cc = cc = c5
Inchi
InChI=1S/C34H39N3O8/c1-22-20-37(33(39)36-31(22)35)32-30(43-19-18-40-2)29(38)28(45-32)21-44-34(23-8-6-5-7-9-23,24-10-14-26(4 1-3) 15-11-21-2401 (42-4-26-27 25-13-23-25 maksatnama (h2,35,36,39,319,319,316) / t289) / TM2, 32-3 / M1 / M1, 32 / M1, 32 / S1
Inchi açary
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Bu madda üçin 24 sany at
5'-O- [Bis (4-MethoxyPhein) -2 -2'-O- (2-metşoksietilyil) -5-Methilyilililiin (ACI); 11: pn: ABŞ20030170636 Sahypa: 17 Sorag bilen talap edildi; 12: pn: ABŞ2003030303021106 sahypasy: 18 talap etdi. 12: pn: ABŞ200303030302121 sahypa: 19 talap edilendigini öňe sürdi. 14: pn: ABŞ2004000569 pag E: 21-de karar berdi. 15: pn: ABŞ20040005565 sahypa: 17- 22 dollar talap edilýän RNa; 15: pn: ABŞ20040005550 sahypa: 19 talap etdi. 15: pn: u s20040006030 sahypasy: 22 talap r n n n na; 15: pn: ABŞ20040044048 sahypa R N NA-yň wagty talap edildi. 16: pn: ABŞ2003017133-nji sahypa: 9 talap RNA; 16: pn: ABŞ20030198966 sahypasy: 19 talap etdi. 16: pn: ABŞ200400474 sahypasy: 19 talap etdi. 16: pn: ABŞ2004001404949 sahypasy:
19 sany talap etdi; 17: pn: ABŞ20040014051 sahypa: 21-NJI talap etdi. 17: pn: ABŞ20040014699-njy ýyla çenli: 19 talap etdi. 17: Pn: w
O03106645 sahypa: 69 talapçynyň aýdyşy; 18: pn: ABŞ20040006029 sahypasy: 22 talap kararyna 5 talap etdi. 2'-o-mee-meefohoxyyos-5'-o-o-drethokshoksylttryk-5- metitridine; 58: PN: US20030166592 PAGE: 15 claimed R NA; 5: pn: w200005006958 sahypasy: 61 talap etdi; 7: pn: w2000050 07825 sahyp: 61 talap etdi; 82: pn: ABŞ20040171566 sahypasy: 18 talap etdi. 89: pn: ABŞ20040005707 sahypa: 19 talap etdi. 9: pn: w0308444478 sahypa: 56 talap etdi
| Elýeterli häsiýetler |
| Biologiki |
| Himiki |
| Dykyzlygy |
| Lipinski |
| Gurluşy |
| Termylal |
Biologiki
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Bionokententrasiýa faktory | 1.56 | galasy; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.99 | galmak 2; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 6.19 | ph 3; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 38.0 | ph 4; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 116 | ph 5; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 146 | ph 6; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 150 | ph 7; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 151 | ph 8; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 151 | ph 9; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 151 | ph 10; Memes: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Himiki
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| KOK | 13.0 | galasy; Memes: 25 ° C. | (1) ACD |
| KOK | 16.6 | galmak 2; Memes: 25 ° C. | (1) ACD |
| KOK | 51.8 | ph 3; Memes: 25 ° C. | (1) ACD |
| KOK | 318 | ph 4; Memes: 25 ° C. | (1) ACD |
| KOK | 966 | ph 5; Memes: 25 ° C. | (1) ACD |
| KOK | 1220 | ph 6; Memes: 25 ° C. | (1) ACD |
| KOK | 1260 | ph 7; Memes: 25 ° C. | (1) ACD |
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| KOK | 1260 | ph 8; Memes: 25 ° C. | (1) ACD |
| KOK | 1260 | ph 9; Memes: 25 ° C. | (1) ACD |
| KOK | 1260 | ph 10; Memes: 25 ° C. | (1) ACD |
| surnal | 1.18 | galasy; Memes: 25 ° C. | (1) ACD |
| surnal | 1.29 | galmak 2; Memes: 25 ° C. | (1) ACD |
| surnal | 1.78 | ph 3; Memes: 25 ° C. | (1) ACD |
| surnal | 2.57 | ph 4; Memes: 25 ° C. | (1) ACD |
| surnal | 3.05 | ph 5; Memes: 25 ° C. | (1) ACD |
| surnal | 3.16 | ph 6; Memes: 25 ° C. | (1) ACD |
| surnal | 3.17 | ph 7; Memes: 25 ° C. | (1) ACD |
| surnal | 3.17 | ph 8; Memes: 25 ° C. | (1) ACD |
| surnal | 3.17 | ph 9; Memes: 25 ° C. | (1) ACD |
| surnal | 3.17 | ph 10; Memes: 25 ° C. | (1) ACD |
| dilim | 3.169 ± 0.598 | Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin gitmek | 5.2 x 10-3 G / L. | Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 0.51 g / l | galasy; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 0.40 g / l | galmak 2; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 0,13 g / l | ph 3; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 0.020 g / l | ph 4; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 6.8 x 10-3 G / L. | ph 5; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 5.4 x 10-3 g / l | ph 6; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 5.3 x 10-3 g / l | ph 7; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 5.2 x 10-3 G / L. | ph 8; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 5.2 x 10-3 G / L. | ph 9; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 5.2 x 10-3 G / L. | ph 10; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 5.3 x 10-3 g / l | Siňdirilmedik suw ph ph 7.05; Memes: 25 ° C. | (1) ACD |
| Mollar içerki çözgüt | 8.4 x 10-6 mol / l | Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 8.2 x 10-4 mol / l | galasy; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 6.4 x 10-4 mol / l | galmak 2; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 2.1 x 10-4 mol / l | ph 3; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 3.3 x 10-5 mol / l | ph 4; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 1.1 x 10-5 mol / l | ph 5; Memes: 25 ° C. | (1) ACD |
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Molar selubkasy | 8.7 x 10-6 mol / l | ph 6; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 8.5 x 10-6 mol / l | ph 7; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 8.4 x 10-6 mol / l | ph 8; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 8.4 x 10-6 mol / l | ph 9; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 8.4 x 10-6 mol / l | ph 10; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 8.5 x 10-6 mol / l | Siňdirilmedik suw ph ph 7.05; Memes: 25 ° C. | (1) ACD |
| Molekulýar agramy | 617.69 | ||
| pka | 13.31 ± 0.70 | "Kisidik temp: 25 ° C. | (1) ACD |
| pka | 4.58 ± 0.10 | Esasy temp: 25 ° C. | (1) ACD |
| Bug basyşy | 1.89 x 10-24 torr | Memes: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Dykyzlygy
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Dykyzlygy | 1.27 ± 0,1,1 G / CM3 | Bu bellik: 20 ° C; MEKDEB: 760 torr | (1) ACD |
| Woll nukagly | 483.8 ± 7.0 CM3 / mool | Bu bellik: 20 ° C; MEKDEB: 760 torr | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Lipinski
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Erkin aýlanýan baglanyşyklar | 14 | (1) ACD | |
| H. | 11 | (1) ACD | |
| H donorlar | 3 | (1) ACD | |
| H donor / kabul ediji jem | 14 | (1) ACD | |
| dilim | 3.169 ± 0.598 | Memes: 25 ° C. | (1) ACD |
| Molekulýar agramy | 617.69 |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Gurluşy
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Polýar ýer meýdany | 134 A2 | (1) ACD | |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Termylal
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Gaýnatmak nokady | 762.6 ± 70.0 ° C. | MEKDEB: 760 torr | (1) ACD |
| Buglygyň ýanynda | 116.53 ±3 ± 3.0 KJ / MOL | MEKDEB: 760 torr | (1) ACD |
| Fleşko nokat | 415.0 ± 35.7 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Spektrler bar
1H nmr
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