C21H23N3O5 L-ORNITHINE, N5- (AMINOCARBONYL) -N2-[(9H-Fluoren-9 -ylmethoxy) carbonyl]-(9CI, ACI)
Priodweddau Ffisegol Allweddol | Gwerthfawrogom | Cyflyrasoch |
Pwysau moleciwlaidd | 397.43 | - |
Berwbwynt (a ragwelir) | 671.5 ± 55.0 ° C. | Gwasg: 760 Torr |
Dwysedd (a ragwelir) | 1.316 ± 0.06 g/cm3 | Temp: 20 ° C; Gwasg: 760 Torr |
PKA (a ragwelir) | 3.84 ± 0.21 | Mwyaf Temp Asidig: 25 ° C. |
Gwenau canonaidd o = c (occ1c = 2c = cc = cc2c = 3c = cc = cc31) nc (c (= o) o) cccnc (= o) n
Gwên Isomerig C (OC (N [C @@ H] (CCCNC (N) = O) C (O) = O) = O) C1C = 2C (C = 3C1 = CC = CC3) = CC = CC = CC2
Inchi
InChI=1S/C21H23N3O5/c22-20(27)23-11-5-10-18(19(25)26)24-21(28)29-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17-18H, 5,10-12H2, (H, 24,28) (h, 25,26) (H3,22,23,27)/T18-/M0/S1
Allwedd inchi
Nbmsmzsrtiofok-sfhvurjksa-n
6 ENW arall ar gyfer y sylwedd hwn
N5- (aminocarbonyl)-N2-[(9H-fluoren-9 -ylmethoxy) carbonyl] -l-ornithine (ACI); (2s) -5- (carbamoylamino) -2- (9H-fluoren-9 -ylmethox ycarbonylamino) asid pentanoic; (2s) -5- (carbamoylamino) -2-([(9H-fluoren-9-il) methoxy] carbonyl] amino) asid pentanoic; 218: PN: U S20070042401 Tudalen: 29 Protein honedig; 909: PN: WO2006135786 Tudalen: 59 Protein Hawliedig; Fmoc-l-citrulline
Sbectra ar gael
1h nmr
13c nmr
Torfol
Eiddo ar gael |
Biolegol |
Gemegol |
Ddwysedd |
Lipinski |
Strwythur yn gysylltiedig |
Thermol |
Biolegol
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Ffactor Bio -ganolbwynt | 54.3 | Ph 1; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 52.8 | Ph 2; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 40.0 | Ph 3; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 11.7 | Ph 4; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.45 | Ph 5; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 6; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 7; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 8; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 9; TEMP: 25 ° C. | (1) ACD |
Ffactor Bio -ganolbwynt | 1.0 | Ph 10; TEMP: 25 ° C. | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Gemegol
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Koc | 606 | Ph 1; TEMP: 25 ° C. | (1) ACD |
Koc | 589 | Ph 2; TEMP: 25 ° C. | (1) ACD |
Koc | 446 | Ph 3; TEMP: 25 ° C. | (1) ACD |
Koc | 130 | Ph 4; TEMP: 25 ° C. | (1) ACD |
Koc | 16.2 | Ph 5; TEMP: 25 ° C. | (1) ACD |
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Koc | 1.76 | Ph 6; TEMP: 25 ° C. | (1) ACD |
Koc | 1.0 | Ph 7; TEMP: 25 ° C. | (1) ACD |
Koc | 1.0 | Ph 8; TEMP: 25 ° C. | (1) ACD |
Koc | 1.0 | Ph 9; TEMP: 25 ° C. | (1) ACD |
Koc | 1.0 | Ph 10; TEMP: 25 ° C. | (1) ACD |
log | 2.59 | Ph 1; TEMP: 25 ° C. | (1) ACD |
log | 2.57 | Ph 2; TEMP: 25 ° C. | (1) ACD |
log | 2.45 | Ph 3; TEMP: 25 ° C. | (1) ACD |
log | 1.92 | Ph 4; TEMP: 25 ° C. | (1) ACD |
log | 1.01 | Ph 5; TEMP: 25 ° C. | (1) ACD |
log | 0.05 | Ph 6; TEMP: 25 ° C. | (1) ACD |
log | -0.76 | Ph 7; TEMP: 25 ° C. | (1) ACD |
log | -1.10 | Ph 8; TEMP: 25 ° C. | (1) ACD |
log | -1.15 | Ph 9; TEMP: 25 ° C. | (1) ACD |
log | -1.16 | Ph 10; TEMP: 25 ° C. | (1) ACD |
logio | 2.591 ± 0.426 | TEMP: 25 ° C. | (1) ACD |
Hydoddedd cynhenid torfol | 4.8 x 10-3 g/l | TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 4.8 x 10-3 g/l | Ph 1; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 5.2 x 10-3 g/l | Ph 2; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 6.8 x 10-3 g/l | Ph 3; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.023 g/l | Ph 4; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.18 g/l | Ph 5; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 1.7 g/l | Ph 6; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 11 g/l | Ph 7; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 23 g/l | Ph 8; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 27 g/l | Ph 9; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 27 g/l | Ph 10; TEMP: 25 ° C. | (1) ACD |
Hydoddedd torfol | 0.032 g/l | Dŵr heb ei drin pH 4.18; TEMP: 25 ° C. | (1) ACD |
Hydoddedd cynhenid molar | 1.2 x 10-5 mol/l | TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.2 x 10-5 mol/l | Ph 1; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.3 x 10-5 mol/l | Ph 2; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 1.7 x 10-5 mol/l | Ph 3; TEMP: 25 ° C. | (1) ACD |
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Hydoddedd molar | 5.7 x 10-5 mol/l | Ph 4; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 4.6 x 10-4 mol/l | Ph 5; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 4.2 x 10-3 mol/l | Ph 6; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 0.027 mol/l | Ph 7; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 0.059 mol/l | Ph 8; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 0.067 mol/l | Ph 9; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 0.068 mol/l | Ph 10; TEMP: 25 ° C. | (1) ACD |
Hydoddedd molar | 8.0 x 10-5 mol/l | Dŵr heb ei drin pH 4.18; TEMP: 25 ° C. | (1) ACD |
Pwysau moleciwlaidd | 397.43 | ||
PKA | 3.84 ± 0.21 | Mwyaf Temp Asidig: 25 ° C. | (1) ACD |
PKA | -0.21 ± 0.70 | Temp mwyaf sylfaenol: 25 ° C. | (1) ACD |
Pwysau anwedd | 6.01 x 10-19 Torr | TEMP: 25 ° C. | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Ddwysedd
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Ddwysedd | 1.316 ± 0.06 g/cm3 | Temp: 20 ° C; Gwasg: 760 Torr | (1) ACD |
Cyfaint molar | 301.8 ± 3.0 cm3/mol | Temp: 20 ° C; Gwasg: 760 Torr | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Lipinski
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Bondiau rotatable yn rhydd | 9 | (1) ACD | |
H Derbynyddion | 8 | (1) ACD | |
H rhoddwyr | 5 | (1) ACD | |
H rhoddwr/derbynnydd swm | 13 | (1) ACD | |
logio | 2.591 ± 0.426 | TEMP: 25 ° C. | (1) ACD |
Pwysau moleciwlaidd | 397.43 |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Strwythur yn gysylltiedig
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Arwynebedd pegynol | 131 A2 | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Thermol
Eiddo | Gwerthfawrogom | Cyflyrasoch | Ffynhonnell |
Berwbwyntiau | 671.5 ± 55.0 ° C. | Gwasg: 760 Torr | (1) ACD |
Enthalpi anweddiad | 103.64 ± 3.0 kj/mol | Gwasg: 760 Torr | (1) ACD |
Phwynt fflach | 359.9 ± 31.5 ° C. | (1) ACD |
(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)
Sbectra ar gael
1h nmr
13c nmr
Rhestr Reoleiddio: IECSC, TCSI, VNECI Gwybodaeth Busnes Cyfrinachol: Cyhoeddus
Cyfystyron rheoleiddio | ||
FMOC-L-2-AMINO-5-UREIDO-N-VALERIC Asid | IECSC | - |
L-ornithine, n5- (aminocarbonyl) -n2-[(9h-fluoren-9 -ylmethoxy) carbonyl]- | Tcsi, vneci | - |
Manylion yn ôl Rhestrau Gwlad/Rhyngwladol a Rhestrau Eraill Gwybodaeth Gwlad/Rhanbarth ar gael
Crynodeb o China
Statws Rhestr ar IECSC
Rhestr o sylweddau cemegol presennol yn Tsieina Enw (au) Rhestredig: FMOC-L-2-AMINO-5-UREIDO-N-VALERIC
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Statws Rhestr ar Gazette Llywodraeth TCSI Taiwan
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Statws Rhestr ar VNECI
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