Compound Summary
Compound Information
Bisoprolol fumarate
Compound Name: | Bisoprolol fumarate |
Compound CID: | 5281064 |
Synonyms: | Bisoprolol fumarate 104344-23-2 Bisoprolol hemifumarate Bisoprolol hemifumarate salt Zebeta More... |
Iupac Name: | (E)-but-2-enedioic acid;1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]propan-2-ol |
InChI: | InChI=1S/2C18H31NO4.C4H4O4/c2*1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4;5-3(6)1-2-4(7)8/h2*5-8,14-15,17,19-20H,9-13H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+ |
InChIKey: | VMDFASMUILANOL-WXXKFALUSA-N |
Canonical Smiles: | CC(C)NCC(COC1=CC=C(C=C1)COCCOC(C)C)O.CC(C)NCC(COC1=CC=C(C=C1)COCCOC(C)C)O.C(=CC(=O)O)C(=O)O |
Isomeric Smiles: | CC(C)NCC(COC1=CC=C(C=C1)COCCOC(C)C)O.CC(C)NCC(COC1=CC=C(C=C1)COCCOC(C)C)O.C(=C/C(=O)O)\C(=O)O |
Molecular Weight: | 767 |
Molecular Formula: | C40H66N2O12 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Bisoprolol fumarate
Molecular Weight: | 767 |
Molecular Formula: | C40H66N2O12 |
Hydrogen Bond Donor Count: | 6 |
Hydrogen Bond Acceptor Count: | 14 |
Rotatable Bond Count: | 26 |
Heavy Atom Count: | 54 |
Complexity: | 397 |
Synonyms
Bisoprolol fumarate
| Bisoprolol fumarate | Bisoprolol fumarate |
|---|---|
Bisoprolol fumarate |
104344-23-2 |
Bisoprolol hemifumarate |
Bisoprolol hemifumarate salt |
Zebeta |
Fondril |
Maintate |
Monocor |
Concor |
Emcor |
Soprol |
(+/-)-Bisoprolol hemifumarate |
NCGC00094255-01 |
(+/-)-Bisoprolol (hemifumarate) |
(E)-but-2-enedioic acid;1-(propan-2-ylamino)-3-4-(2-propan-2-yloxyethoxymethyl)phenoxypropan-2-ol |
TA-4708 |
DSSTox_CID_25794 |
DSSTox_RID_81134 |
DSSTox_GSID_45794 |
2-PROPANOL, 1-4-2-(1-METHYLETHOXY)ETHOXYMETHYLPHENOXY-3-(1-METHYLETHYL)AMINO-, (2E)-2-BUTENEDIOATE (2:1) |
but-2-enedioic acid;1-(propan-2-ylamino)-3-4-(2-propan-2-yloxyethoxymethyl)phenoxypropan-2-ol |
( inverted exclamation markA)-Bisoprolol (hemifumarate) |
CL 297,939 |
Bisobloc |
Bisomerck |
Detensiel |
Emvoncor |
Eurtadal |
Zabesta |
Godal |
Isoten |
Biso-Puren |
CHEBI:3128 |
Concor Plus Forte |
CAS-104344-23-2 |
EMD-33512 |
MFCD00792743 |
EMD-33-512 |
(+-)-1-(p-((2-Isopropoxyethoxy)methyl)phenoxy)-3-isopropylamino-2-propanol hemifumarate |
NCGC00024868-03 |
(+-)-1-((alpha-(2-Isopropoxyethoxy)-p-tolyl)oxy)-3-(isopropylamino)-2-propanol fumarate (2:1) (salt) |
CL-297939 |
Bisoprolol fumarate USAN:USP:JAN |
EMD 33512 |
Zebeta (TN) |
bisoprolol hemi fumarate salt |
SCHEMBL41418 |
Bisoprolol hemifumarate- Bio-X |
CHEMBL1472989 |
DTXSID1045794 |
Bisoprolol fumarate (JP17/USP) |
HMS2096A21 |
HMS3262P04 |
HMS3267A19 |
HMS3411F20 |
HMS3675F20 |
HMS3713A21 |
HY-B0076 |
2C18H31NO4.C4H4O4 |
Tox21_111262 |
Tox21_113409 |
Tox21_500951 |
AKOS015994663 |
Tox21_111262_1 |
CCG-220330 |
CCG-222255 |
CS-1770 |
KS-1033 |
LP00951 |
NSC 759181 |
NCGC00024868-09 |
NCGC00261636-01 |
BB164256 |
D00634 |
344B232 |
A800961 |
SR-01000838106 |
Bisoprolol hemifumarate salt, >=98% (HPLC), solid |
SR-01000838106-2 |
( inverted exclamation markA)-Bisoprolol hemifumarate |
Q27105947 |
Bisoprolol Fumarate 1.0 mg/ml in Methanol (as free base) |
Bisoprolol fumarate, European Pharmacopoeia (EP) Reference Standard |
Bisoprolol fumarate, United States Pharmacopeia (USP) Reference Standard |
Bisoprolol for peak identification, European Pharmacopoeia (EP) Reference Standard |
Bisoprolol for system suitability, European Pharmacopoeia (EP) Reference Standard |
(+/-)-1-4-2-(1-Methylethoxy)ethoxy)methylphenoxy-3-(1-methylethyl)amino-2-propanol hemifumarate |
(AfAEA centa notA inverted exclamation markAfasAA inverted exclamation markAfAEAdaggeratrade markAfA centA centa notA inverted exclamation markAA not)-Bisoprolol (hemifumarate) |
1-(4-((2-isopropoxyethoxy)Methyl)phenoxy)-3-(isopropylaMino)propan-2-ol fuMarate;(+/-)-Bisoprolol Hemifumarate |
2-Propanol, 1-(4-((2-(1-methylethoxy)ethoxy)methyl)phenoxy)-3-((1-methylethyl)amino)-, (+-)-, (E)-2-butenedioate (2:1) (salt) |
Experimental Data
Bisoprolol fumarate
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33 | umol/L | 4 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
Bisoprolol fumarate
Statistics Data
Bisoprolol fumarate
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 4 | 1 | 1 |
Statistics Data Visualization
Bisoprolol fumarate
