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C21H23N3O5 L-Ornithine, N5- (aminocarbonyl) -N2 - [(9H-fluoren-9-ylmethoxy) karubone] - (9CI, ACI)
| Ibyingenzi Byumubiri | Agaciro | Imiterere |
| Uburemere bwa molekile | 397.43 | - |
| Ingingo yo guteka (Biteganijwe) | 671.5 ± 55.0 ° C. | Kanda: 760 Torr |
| Ubucucike (Biteganijwe) | 1.316 ± 0.06 g / cm3 | Ubushyuhe: 20 ° C;Kanda: 760 Torr |
| pKa (Byahanuwe) | 3.84 ± 0.21 | Ubushyuhe bwinshi bwa Acide: 25 ° C. |
Urwenya rwa Canonical O = C (OCC1C = 2C = CC = CC2C = 3C = CC = CC31) NC (C (= O) O) CCCNC (= O) N
SMILES Isomeric C (OC (N [C @@ H] (CCCNC (N) = O) C (O) = O) = O) C1C = 2C (C = 3C1 = CC = CC3) = 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
InChI Urufunguzo
NBMSMZSRTIOFOK-SFHVURJKSA-N
6 Andi mazina kuriyi ngingo
N5- (Aminocarbonyl) -N2 - [(9)H-fluoren-9-ylmethoxy) karubone] -L-ornithine (ACI);(2S) -5- (Carbamoylamino) -2- (9H-fluoren-9-ylmethox ycarbonylamino) aside pentanoic;(2S) -5- (Carbamoylamino) -2 - ([[(9)H-fluoren-9-yl) imikorerexy] karubone] amino) aside pentanoic;218: PN: U S20070042401 URUPAPURO: 29 isaba poroteyine;909: PN: WO2006135786 URUPAPURO: 59 isaba poroteyine;Fmoc-L-Citrulline
Spectra irahari
1H NMR
13C NMR
Misa
| Ibyiza birahari |
| Ibinyabuzima |
| Imiti |
| Ubucucike |
| Lipinski |
| Imiterere ijyanye |
| Ubushyuhe |
Ibinyabuzima
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Ikintu cya Bioconcentration | 54.3 | pH 1;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 52.8 | pH 2;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 40.0 | pH 3;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 11.7 | pH 4;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.45 | pH 5;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.0 | pH 6;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.0 | pH 7;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.0 | pH 8;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.0 | pH 9;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.0 | pH 10;Ubushyuhe: 25 ° C. | (1) ACD |
.
Imiti
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Koc | 606 | pH 1;Ubushyuhe: 25 ° C. | (1) ACD |
| Koc | 589 | pH 2;Ubushyuhe: 25 ° C. | (1) ACD |
| Koc | 446 | pH 3;Ubushyuhe: 25 ° C. | (1) ACD |
| Koc | 130 | pH 4;Ubushyuhe: 25 ° C. | (1) ACD |
| Koc | 16.2 | pH 5;Ubushyuhe: 25 ° C. | (1) ACD |
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Koc | 1.76 | pH 6;Ubushyuhe: 25 ° C. | (1) ACD |
| Koc | 1.0 | pH 7;Ubushyuhe: 25 ° C. | (1) ACD |
| Koc | 1.0 | pH 8;Ubushyuhe: 25 ° C. | (1) ACD |
| Koc | 1.0 | pH 9;Ubushyuhe: 25 ° C. | (1) ACD |
| Koc | 1.0 | pH 10;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 2.59 | pH 1;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 2.57 | pH 2;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 2.45 | pH 3;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 1.92 | pH 4;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 1.01 | pH 5;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 0.05 | pH 6;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | -0.76 | pH 7;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | -1.10 | pH 8;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | -1.15 | pH 9;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | -1.16 | pH 10;Ubushyuhe: 25 ° C. | (1) ACD |
| logP | 2.591 ± 0.426 | Ubushyuhe: 25 ° C. | (1) ACD |
| Mass Massins Solubility | 4.8 x 10-3 g / L. | Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 4.8 x 10-3 g / L. | pH 1;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 5.2 x 10-3 g / L. | pH 2;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 6.8 x 10-3 g / L. | pH 3;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 0.023 g / L. | pH 4;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 0.18 g / L. | pH 5;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 1.7 g / L. | pH 6;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 11 g / L. | pH 7;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 23 g / L. | pH 8;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 27 g / L. | pH 9;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 27 g / L. | pH 10;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 0.032 g / L. | Amazi adafite amazi pH 4.18;Ubushyuhe: 25 ° C. | (1) ACD |
| Molar Intrinsic Solubility | 1.2 x 10-5 mol / L. | Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 1.2 x 10-5 mol / L. | pH 1;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 1.3 x 10-5 mol / L. | pH 2;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 1.7 x 10-5 mol / L. | pH 3;Ubushyuhe: 25 ° C. | (1) ACD |
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Amashanyarazi | 5.7 x 10-5 mol / L. | pH 4;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 4.6 x 10-4 mol / L. | pH 5;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 4.2 x 10-3 mol / L. | pH 6;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 0.027 mol / L. | pH 7;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 0.059 mol / L. | pH 8;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 0.067 mol / L. | pH 9;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 0.068 mol / L. | pH 10;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 8.0 x 10-5 mol / L. | Amazi adafite amazi pH 4.18;Ubushyuhe: 25 ° C. | (1) ACD |
| Uburemere bwa molekile | 397.43 | ||
| pKa | 3.84 ± 0.21 | Ubushyuhe bwinshi bwa Acide: 25 ° C. | (1) ACD |
| pKa | -0.21 ± 0.70 | Ubushyuhe bwibanze: 25 ° C. | (1) ACD |
| Umuvuduko w'umwuka | 6.01 x 10-19 Torr | Ubushyuhe: 25 ° C. | (1) ACD |
.
Ubucucike
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Ubucucike | 1.316 ± 0.06 g / cm3 | Ubushyuhe: 20 ° C;Kanda: 760 Torr | (1) ACD |
| Umubumbe wa Molar | 301.8 ± 3.0 cm3 / mol | Ubushyuhe: 20 ° C;Kanda: 760 Torr | (1) ACD |
.
Lipinski
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Impapuro zishobora guhinduka | 9 | (1) ACD | |
| H Abakira | 8 | (1) ACD | |
| H Abaterankunga | 5 | (1) ACD | |
| H Abaterankunga / Abemera Sum | 13 | (1) ACD | |
| logP | 2.591 ± 0.426 | Ubushyuhe: 25 ° C. | (1) ACD |
| Uburemere bwa molekile | 397.43 |
.
Imiterere ijyanye
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Ubuso bwa polarike | 131 A2 | (1) ACD | |
.
Ubushyuhe
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Ingingo | 671.5 ± 55.0 ° C. | Kanda: 760 Torr | (1) ACD |
| Umwuka wo guhumeka | 103.64 ± 3.0 kJ / mol | Kanda: 760 Torr | (1) ACD |
| Flash point | 359.9 ± 31.5 ° C. | (1) ACD |
.
Spectra irahari
1H NMR
13C NMR
Urutonde rugenzura: IECSC, TCSI, VNECI Amakuru Yubucuruzi Yibanga: Rusange
| Amagambo asobanura | ||
| Fmoc-L-2-amino-5-ureido-n-aside aside | IECSC | - |
| L-Ornithine, N5- (aminocarbonyl) -N2 - [(9H-fluoren-9-ylmethoxy) karubone] - | TCSI, VNECI | - |
Ibisobanuro byigihugu / Mpuzamahanga & Izindi Urutonde Igihugu / Akarere Amakuru araboneka
Incamake y'Ubushinwa
Ibarurishamibare kuri IECSC
Ibarura ryibintu bya chimique biriho mubushinwa Urutonde rwamazina (s): Fmoc-L-2-amino-5-ureido-n-valeric aside
Tayiwani Incamake
Ibarurishamibare ku Igazeti ya Guverinoma ya Tayiwani
Vietnam Nam Incamake
Ibarurishamibare kuri VNECI
Vietnam Umushinga wibarura ryimiti yigihugu
