C53h66n7n7O8PE: 104992-55-4 ANENSIN-5 '- Jemi- Metillothil-5' - 3-aranetily Methilithil) fotoHomaidit] (aci)
CAC Hasaba alyş belgisi
104992-55-4-4
Esasy fiziki aýratynlyklary | Bahasy | Ýagdaýy |
Molekulýar agramy | 988.19 | - |
pka (çak edilýär) | 7.87 ± 0.43 | "Kisidik temp: 25 ° C. |
Kanoniki ýylgyryşlar
N # CCCOP (OC1C (OC1C (OC) C. Cc = c (ok) c = c = c = c (c (c (c (c) c (c (c) c (c) c
ISOMICICK ýylgyrýar
Esasy d (C @ C @ c @ c) (op (N) (op (N = C) C (C) C (C) C (C) d (C) C (C) (C) (C) (C) (C) (C) (C) (C @ C) N = CN3) (C5 = CC = C (OC) C (OC) (C6 = CC = C (OC) C (OC) C (c7 = CC = CC = CC = CC = CC = CC = c7
Inchi
InChI= 1S/C53H66N7O8PSi/c1-36(2)60(37(3)4)69(65-32-18-31-54)67-46-44(33-64-53(39-21-16-13-17-22-39,40-23-27-42(62-8)28-24-40 )41-25-29-43(63-9)30-26-41)66-51(47(46)68-70(10,11)52(5,6)7)59-35-57-45-48(55-34-56-49(45)59)58-50(61)38-19-14-12-15-20-38/h1 2-17,12,19-30,34,49-30,34,44333333333333333H1H3, T44-6, 47-, 46-5, 46-, 69, 69, 69? / S1
Inchi açary
FFXNCNSASXCT-RFMFGJHUSTAMA-n
Bu madda üçin başga bir at
Adenozin,N-benzoyl-5 '-O- [Bis (4-Metooxyfheenl) fenlylmmetheli] -2 -2 '-O- [1-drametikithilthil) dimi
Spektrler bar
Massa
Elýeterli häsiýetler
Biologiki
Himiki
Lipinski
Gurluşy
Emläk | Bahasy | Ýagdaýy | Çeşme |
Bionokententrasiýa faktory | 5.50 x 105 | galasy; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.00 x 106 | galmak 2; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.00 x 106 | ph 3; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.00 x 106 | ph 4; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.00 x 106 | ph 5; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.00 x 106 | ph 6; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.00 x 106 | ph 7; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.00 x 106 | ph 8; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.00 x 106 | ph 9; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.00 x 106 | ph 10; Memes: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Emläk | Bahasy | Ýagdaýy | Çeşme |
KOK | 61500 | galasy; Memes: 25 ° C. | (1) ACD |
KOK | 1.64 x 106 | galmak 2; Memes: 25 ° C. | (1) ACD |
KOK | 1.00 x 107 | ph 3; Memes: 25 ° C. | (1) ACD |
KOK | 1.00 x 107 | ph 4; Memes: 25 ° C. | (1) ACD |
KOK | 1.00 x 107 | ph 5; Memes: 25 ° C. | (1) ACD |
KOK | 1.00 x 107 | ph 6; Memes: 25 ° C. | (1) ACD |
KOK | 1.00 x 107 | ph 7; Memes: 25 ° C. | (1) ACD |
KOK | 1.00 x 107 | ph 8; Memes: 25 ° C. | (1) ACD |
KOK | 3.20 x 106 | ph 9; Memes: 25 ° C. | (1) ACD |
Emläk | Bahasy | Ýagdaýy | Çeşme |
KOK | 9.24 x 105 | ph 10; Memes: 25 ° C. | (1) ACD |
surnal | 8.81 | galasy; Memes: 25 ° C. | (1) ACD |
surnal | 10.24 | galmak 2; Memes: 25 ° C. | (1) ACD |
surnal | 11.24 | ph 3; Memes: 25 ° C. | (1) ACD |
surnal | 11.73 | ph 4; Memes: 25 ° C. | (1) ACD |
surnal | 11.83 | ph 5; Memes: 25 ° C. | (1) ACD |
surnal | 11.83 | ph 6; Memes: 25 ° C. | (1) ACD |
surnal | 11.75 | ph 7; Memes: 25 ° C. | (1) ACD |
surnal | 11.31 | ph 8; Memes: 25 ° C. | (1) ACD |
surnal | 10.53 | ph 9; Memes: 25 ° C. | (1) ACD |
surnal | 9.99 | ph 10; Memes: 25 ° C. | (1) ACD |
dilim | 11.845 ± 0.715 | Memes: 25 ° C. | (1) ACD |
Köpçülikleýin gitmek | 1.2 x 10-5 g / l | Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 3.5 x 10-3 g / l | galasy; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 1.1 x 10-4 g / l | galmak 2; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 9.9 x 10-6 g / l | ph 3; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 3.4 x 10-6 g / l | ph 4; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 2.7 x 10-6 g / l | ph 5; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 2.7 x 10-6 g / l | ph 6; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 3.2 x 10-6 g / l | ph 7; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 8.9 x 10-6 g / l | ph 8; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 6.3 x 10-5 g / l | ph 9; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 4.2 x 10-4 g / l | ph 10; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 3.2 x 10-6 g / l | Siňdirilmedik suw ph ph 7.00; Memes: 25 ° C. | (1) ACD |
Mollar içerki çözgüt | 1.2 x 10-8 mol / l | Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 3.5 x 10-6 mol / l | galasy; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.1 x 10-7 mol / l | galmak 2; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.0 x 10-8 mol / l | ph 3; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 3.4 x 10-9 mol / l | ph 4; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 2.7 x 10-9 mol / l | ph 5; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 2.7 x 10-9 mol / l | ph 6; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 3.2 x 10-9 mol / l | ph 7; Memes: 25 ° C. | (1) ACD |
Emläk | Bahasy | Ýagdaýy | Çeşme |
Molar selubkasy | 9.0 x 10-9 mol / l | ph 8; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 6.4 x 10-8 mol / l | ph 9; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 4.2 x 10-7 mol / l | ph 10; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 3.2 x 10-9 mol / l | Siňdirilmedik suw ph ph 7.00; Memes: 25 ° C. | (1) ACD |
Molekulýar agramy | 988.19 | ||
pka | 7.87 ± 0.43 | "Kisidik temp: 25 ° C. | (1) ACD |
pka | 3.45 ± 0.70 | Esasy temp: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Emläk | Bahasy | Ýagdaýy | Çeşme |
Erkin aýlanýan baglanyşyklar | 21 | (1) ACD | |
H. | 15 | (1) ACD | |
H donorlar | 1 | (1) ACD | |
H donor / kabul ediji jem | 16 | (1) ACD | |
dilim | 11.845 ± 0.715 | Memes: 25 ° C. | (1) ACD |
Molekulýar agramy | 988.19 |
Emläk | Bahasy | Ýagdaýly çeşme |
Polýar ýer meýdany | 178 A2 | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Ösen himiýa ösüşi (ACD / Labors) programma üpjünçiligi v11.02 (© 1994-20233 ACD / laboratoriýa)
Spektrler bar
1 h nmr
13 c nmr