
无数据
无数据
无数据
| CAS Number | 75847-73-3 |
| Catalog Number | AG0059VJ(AGN-PC-0OHPY6) |
| Chemical Name | Enalapril |
| IUPAC Name | (2S)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid |
| InChI | InChI=1S/C20H28N2O5/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25)/t14-,16-,17-/m0/s1 |
| InChI Key | GBXSMTUPTTWBMN-XIRDDKMYSA-N |
| MDL Number | MFCD00865774 |
| Molecular Formula | C20H28N2O5 |
| Molecular Weight | 376.4467 |
| SMILES | O=C([C@H]1N(CCC1)C([C@@H](N[C@@H](CCC2=CC=CC=C2)C(OCC)=O)C)=O)O |
| UNII | 69PN84IO1A |
| Synonyms | Enalapril,
Enalapril Maleate,
Maleate, Enalapril,
MK 421,
MK-421,
MK421,
Renitec,
Renitek,
enalapril,
75847-73-3,
Enalapril maleate,
Enalaprilum,
Vasotec,
Enalaprila,
UNII-69PN84IO1A,
Enalapril Richet,
CHEMBL578,
69PN84IO1A,
CHEBI:4784,
Enalaprilum [INN-Latin],
Enalaprila [INN-Spanish],
GBXSMTUPTTWBMN-XIRDDKMYSA-N,
C20H28N2O5,
NCGC00021569-04,
Enalapril [INN:BAN],
DSSTox_CID_2982,
1-(N-((S)-1-Carboxy-3-phenylpropyl)-L-alanyl)-L-proline 1'-ethyl ester,
DSSTox_RID_76817,
DSSTox_GSID_22982,
Epaned,
L-Proline, N-[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]-L-alanyl-,
Enalapril (INN),
Enalapril (TN),
(2S)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid,
(2S)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]pyrrolidine-2-carboxylic acid,
(S)-1-{(S)-2-[1-((S)-Ethoxycarbonyl)-3-phenyl-propylamino]-propionyl}-pyrrolidine-2-carboxylic acid,
CAS-75847-73-3,
(S)-1-(N-(1-(Ethoxycarbonyl)-3-phenylpropyl)-L-alanyl)-L-proline,
76095-16-4,
analapril,
Enaladex,
L-Proline, N-((1S)-1-(ethoxycarbonyl)-3-phenylpropyl)-L-alanyl-,
L-Proline, 1-(N-(1-(ethoxycarbonyl)-3-phenylpropyl)-L-alanyl)-, (S)-,
Enalapril, AldrichCPR,
Spectrum_001307,
SCHEMBL18,
AC1NTUS5,
Prestwick3_000314,
Spectrum2_001455,
Spectrum3_001478,
Spectrum4_000008,
Spectrum5_001107,
Enalapril Maleate Usp Xxi,
BSPBio_000308,
BSPBio_003035,
KBioGR_000355,
KBioSS_001787,
BIDD:GT0751,
DivK1c_000408,
SPBio_001349,
BPBio1_000340,
GTPL6322,
PRO106,
DTXSID5022982,
CTK8F9436,
KBio1_000408,
KBio2_001787,
KBio2_004355,
KBio2_006923,
KBio3_002535,
NINDS_000408,
HMS2090E08,
HY-B0331,
N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl-L-proline,
ZINC3791297,
Tox21_110872,
BDBM50017129,
N-{(1S)-1-[(ethyloxy)carbonyl]-3-phenylpropyl}-L-alanyl-L-proline,
AKOS025310615,
Tox21_110872_1,
API0002541,
CS-2918,
DB00584,
IDI1_000408,
NCGC00016932-01,
NCGC00021569-05,
NCGC00021569-06,
NCGC00021569-09,
CC-27456,
K298,
SC-17520,
SC-76440,
SBI-0051691.P002,
CAS-76095-16-4,
LS-190651,
C06977,
D07892,
AB00053615-17,
AB00053615-18,
AB00053615_19,
AB00053615_20,
847E733,
C-21264,
BRD-K57545991-050-16-5,
N-(1(S)-Ethoxycarbonyl-3-phenylpropyl)-L-alanyl-L-proline,
((S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl)-L-alanyl-L-proline,
(S)-1-[N-[1-(ETHOXYCARBONXYL)-3-PHENYLPROPYL]-L-AL,
N-[1-(S)-ethoxycarbonyl-3-phenylpropyl]-L-alanyl-L-proline,
Nalpha -[(S)-1-ethoxycarbonyl-3-phenylpropyl]-L-alanyl-L-proline,
(SSS)1-[2-(1-Ethoxycarbonyl-3-phenyl-propylamino)-propionyl]-pyrrolidine-2-carboxylic acid,
1-[2-(1-Ethoxycarbonyl-3-phenyl-propylamino)-propionyl]-pyrrolidine-2-carboxylic acid,
(S)-1-((S)-2-((R)-1-ethoxy-1-oxo-4-phenylbutan-2-ylamino)propanoyl)pyrrolidine-2-carboxylic acid,
(S)-1-[(R)-2-((R)-1-Ethoxycarbonyl-3-phenyl-propylamino)-propionyl]-pyrrolidine-2-carboxylic acid,
(S,S,S)-1-[2-(1-Ethoxycarbonyl-3-phenyl-propylamino)-propionyl]-pyrrolidine-2-carboxylic acid,
1-[2-(1-Ethoxycarbonyl-3-phenyl-propylamino)-propionyl]-pyrrolidine-2-carboxylic acid (Enalapril),
1-[2-(1-Ethoxycarbonyl-3-phenyl-propylamino)-propionyl]-pyrrolidine-2-carboxylic acid(enalapril),
2-[2-(1-Carboxy-3-phenyl-propylamino)-propionyl]-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid(enalapril),
Gadopril,
Vaseretic,
Bonuten,
Kinfil,
Lexxel,
Enalaprilat,
Enarenal,
Renitec,
Renitek,
Maleate, Enalapril,
Renitec (TN),
Vasotec (TN),
TECZEM,
D00SEB,
MK421,
MK 421,
MK-421,
C20-H28-N2-O5,
CID5388962,
CS-O-00226,
D004656,
L-prolina, N-[(1S)-1-(etoxicarbonilo)-3-fenilpropil]-L-alanil-,
N-[(1S)-1-(Ethoxycarbonyl)-3-phenylpropyl]-L-alanyl-L-proline,
|
| Complexity | 519 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 376.2g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 376.453g/mol |
| Monoisotopic Mass | 376.2g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 95.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
| Symbol: | |
| Hazard Class | 6.1 |
| Hazard statements | H317-H361 |
| Packing Group | Ⅲ |
| Precautionary statements | P280 |
| UN Code | UN 2811 |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
| Test: | Result: |

