C47H60N7O10P guanosine, 5 ′ -O- [bis (4-metoxýfenýl) fenýlmetýl] -2 ′ -O- (2- methoxýetýl) -n- (2-metýl-1-oxopropýl)-, 3 ′-[2-cýanóetýl N, N-bis (1-metýletýl) fosphoramidite] (Aci) sem er með (1-Methylethýl) fosphoramidite] (Aci) sem er með (1-metýlethýl).

C47H60N7O10P guanosine, 5 ′ -O- [bis (4-metoxýfenýl) fenýlmetýl] -2 ′ -O- (2- methoxýetýl) -n- (2-metýl-1-oxopropýl)-, 3 ′-[2-cyanoethyl n, n-bis (1-metýletýl) fosforamidite] (aci))

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Efni smáatriði

CAS skrásetningarnúmer

251647-55-9

H302

Lykilatriði eðlisfræðilegra eiginleika	Gildi	Ástand
Mólmassa	914.00	-
PKA (spáð)	9,16 ± 0,20	Sýrtasta temp: 25 ° C

Önnur nöfn og auðkenni

Canonical bros

N#CCCOP (OC1C (OC (N2C = NC = 3C (= O) N = C (NC (= O) C (C) C) NC32) C1OCCOC) COC (C = 4C = CC = CC4) (C5 = CC = C (OC) C = C5) C6 = CC = C (OC) C = C6) N (C (C (C) C (C) C

Isomicer bros

C (OC [C @@ H] 1 [C @@ H] (OP (N (C (C) C) C (C) C) OCCC#N) [C @@ H] (OCCOC) [C @@ H] (O1) N2C3 = C (N = C2) C (= O) N = C (NC (C (C) C) = O) N3) (C4 = CC = C (OC) C = C4) (C5 = CC = C (OC) C = C5) C6 = CC = CC = C6

Tommur

Inchi = 1s/C47H60N7O10p/C1-30 (2) 43 (55) 51-46-50-42-39 (44 (56) 52-46) 49-29-53 (42) 45-41 (60-27-26-57-7) 40 (64-65 (62-25-25-24-48) 31 (3) 4) 32 (5) 6) 38 (63-45) 28-61-47 (33-14-11-10-12-15-33,34-16-20-36 (58-8) 21-17-34) 35-18-22-37 (59-9) 23-19-35/H10-12,14-23,29-32,38 , 40-41,45H, 13,25-28h2,1-9h3, (H2,50,51,52,55,56)/T38-, 40-, 41-, 45-, 65?/M1/S1

Inchi lykill

Ladcdgnebiqaau-sbcraqivsa-n

17 önnur nöfn fyrir þetta efni

Guanosine, 5 ′ -O-[bis (4-metoxýfenýl) fenýlmetýl] -2 ′-O-(2-metoxýetýl)-N-(2-metýl-1-oxóprópýl)-, 3 ′-[2-cyanoethyl bis (1- metýletýl) fosfóramídít] (9ci); 17: PN: US20030212017 Page: 20 krafist röð; 18: PN: US20030211606 Page: 20

krafist röð; 19: PN: US20040005569 Page: 22 krafist röð; 21: PN: US20040006030 Page: 23 krafist röð; 21: PN: US20040014047 Bls: 21 krafist röð; 21: PN: US20040014049 Bls: 21 krafist röð; 22: PN: US20030198965 PAG

E: 20 krafist röð; 22: PN: US20040005570 Page: 21 krafist röð; 22: PN: US20040014048 Bls: 21 krafist röð;

22: PN: US20040014050 Page: 21 krafist röð; 23: PN: US20040005565 Page: 17-22 Kröfur röð; 23: PN: US20040

014051 Bls: 23 kröfur um röð; 24: PN: US20040014699 Bls: 21 krafist röð; 25: PN: US20040006029 Bls: 23 kröfur um röð; 25: PN: WO03106645 Bls: 73 Kröfur röð; 96: PN: US20040005707 Page: 21 krafist röð

Tilrauna litróf

Litróf í boði
13 C nmr
Hetero nmr

Spáð eiginleikum

Eignir í boði
Líffræðileg
Efni
Lipinski
Uppbygging tengd

Líffræðileg

Eign	Gildi	Ástand	Uppspretta
Bioconcentration Factor	121	pH 1; Temp: 25 ° C.	(1) ACD
Bioconcentration Factor	2580	pH 2; Temp: 25 ° C.	(1) ACD
Bioconcentration Factor	23500	Ph 3; Temp: 25 ° C.	(1) ACD
Bioconcentration Factor	71800	pH 4; Temp: 25 ° C.	(1) ACD
Bioconcentration Factor	89800	pH 5; Temp: 25 ° C.	(1) ACD
Bioconcentration Factor	92100	pH 6; Temp: 25 ° C.	(1) ACD
Bioconcentration Factor	91300	pH 7; Temp: 25 ° C.	(1) ACD
Bioconcentration Factor	82500	pH 8; Temp: 25 ° C.	(1) ACD
Bioconcentration Factor	42200	pH 9; Temp: 25 ° C.	(1) ACD
Bioconcentration Factor	7860	pH 10; Temp: 25 ° C.	(1) ACD

Efni

Eign	Gildi	Ástand	Uppspretta
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

Eign	Gildi	Ástand	Uppspretta
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
Massa eðlislægni	4,4 x 10-4 g/l	Temp: 25 ° C.	(1) ACD
Massa leysni	0,34 g/l	pH 1; Temp: 25 ° C.	(1) ACD
Massa leysni	0,016 g/l	pH 2; Temp: 25 ° C.	(1) ACD
Massa leysni	1,7 x 10-3 g/l	Ph 3; Temp: 25 ° C.	(1) ACD
Massa leysni	5,7 x 10-4 g/l	pH 4; Temp: 25 ° C.	(1) ACD
Massa leysni	4,6 x 10-4 g/l	pH 5; Temp: 25 ° C.	(1) ACD
Massa leysni	4,4 x 10-4 g/l	pH 6; Temp: 25 ° C.	(1) ACD
Massa leysni	4,5 x 10-4 g/l	pH 7; Temp: 25 ° C.	(1) ACD
Massa leysni	4,9 x 10-4 g/l	pH 8; Temp: 25 ° C.	(1) ACD
Massa leysni	1,0 x 10-3 g/l	pH 9; Temp: 25 ° C.	(1) ACD
Massa leysni	5,2 x 10-3 g/l	pH 10; Temp: 25 ° C.	(1) ACD
Massa leysni	4,5 x 10-4 g/l	Óbifað vatn pH 6,99; Temp: 25 ° C.	(1) ACD
Molar innri leysni	4,8 x 10-7 mól/l	Temp: 25 ° C.	(1) ACD
Molar leysni	3,7 x 10-4 mól/l	pH 1; Temp: 25 ° C.	(1) ACD
Molar leysni	1,7 x 10-5 mól/l	pH 2; Temp: 25 ° C.	(1) ACD
Molar leysni	1,9 x 10-6 mól/l	Ph 3; Temp: 25 ° C.	(1) ACD

Eign	Gildi	Ástand	Uppspretta
Molar leysni	6,2 x 10-7 mól/l	pH 4; Temp: 25 ° C.	(1) ACD
Molar leysni	5,0 x 10-7 mól/l	pH 5; Temp: 25 ° C.	(1) ACD
Molar leysni	4,8 x 10-7 mól/l	pH 6; Temp: 25 ° C.	(1) ACD
Molar leysni	4,9 x 10-7 mól/l	pH 7; Temp: 25 ° C.	(1) ACD
Molar leysni	5,4 x 10-7 mól/l	pH 8; Temp: 25 ° C.	(1) ACD
Molar leysni	1,1 x 10-6 mól/l	pH 9; Temp: 25 ° C.	(1) ACD
Molar leysni	5,7 x 10-6 mól/l	pH 10; Temp: 25 ° C.	(1) ACD
Molar leysni	4,9 x 10-7 mól/l	Óbifað vatn pH 6,99; Temp: 25 ° C.	(1) ACD
Mólmassa	914.00
PKA	9,16 ± 0,20	Sýrtasta temp: 25 ° C	(1) ACD
PKA	3,45 ± 0,70	Grundvöllurinn: 25 ° C	(1) ACD

Lipinski

Eign	Gildi	Ástand	Uppspretta
Frjálslega snúningsbönd	22		(1) ACD
H samþykki	17		(1) ACD
H styrktaraðilar	2		(1) ACD
H gjafa/samþykki fjárhæð	19		(1) ACD
logp	6,837 ± 0,764	Temp: 25 ° C.	(1) ACD
Mólmassa	914.00