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Indolapril hydrochloride

CAT: 0931-T27608-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T27608-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
80828-32-6
Target
Angiotensin-converting Enzyme (ACE), Others
Related Pathways
Others, Metabolism
Bioactivity
Indolapril hydrochloride is a nonsulfhydryl angiotensin converting enzyme (ACE) inhibitor with antihypertensive activity.
Smiles
C([C@@H](N[C@@H](CCC1=CC=CC=C1)C(OCC)=O)C)(=O)N2[C@@]3([C@](C[C@H]2C(O)=O)(CCCC3)[H])[H].Cl
Molecular Formula
C24H35ClN2O5
Molecular Weight
467
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Indolapril Hydrochloride
CAS Number80828-32-6
PubChem CID10457278
IUPAC Name(2S,3aS,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid;hydrochloride
Molecular FormulaC24H35ClN2O5
Molecular Weight467.0
Topological Polar Surface Area95.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count32
Formal Charge0
Complexity633
SMILES
CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2[C@H]3CCCC[C@H]3C[C@H]2C(=O)O.Cl
InChI
InChI=1S/C24H34N2O5.ClH/c1-3-31-24(30)19(14-13-17-9-5-4-6-10-17)25-16(2)22(27)26-20-12-8-7-11-18(20)15-21(26)23(28)29;/h4-6,9-10,16,18-21,25H,3,7-8,11-15H2,1-2H3,(H,28,29);1H/t16-,18-,19-,20-,21-;/m0./s1
InChIKey
QNSWMJYOGMUVGO-PABIKWFMSA-N
Chemical Structure
2D Structure
2D structure of Indolapril Hydrochloride
CAS: 80828-32-6
CID: 10457278
Formula: C24H35ClN2O5
MW: 467.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight467.0
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass466.2234499
Monoisotopic Mass466.2234499
Topological Polar Surface Area95.9 Ų
Heavy Atom Count32
Formal Charge0
Complexity633
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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