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(E) -10-Hydroxynortriptyline

CAT: 0931-T38131Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T38131Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
47132-16-1
Target
Drug Metabolite
Related Pathways
Metabolism
Purity
0.9936
Bioactivity
(E) -10-Hydroxynortriptyline (E-10-OH-NT) is an active metabolite of Nortriptyline with anxiolytic activity and affinity for muscarinic acetylcholine receptors, which can be used in the study of neurological disorders.
Smiles
C(\CCNC)=C\1/C=2C(C(O)CC=3C1=CC=CC3)=CC=CC2
Molecular Formula
C19H21NO
Molecular Weight
279.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

10-Hydroxynortriptyline, (E)-
CAS Number47132-16-1
PubChem CID6440567
IUPAC Name(2E)-2-[3-(methylamino)propylidene]tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-9-ol
Molecular FormulaC19H21NO
Molecular Weight279.4
XLogP3.4
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity365
SMILES
CNCC/C=C/1\C2=CC=CC=C2CC(C3=CC=CC=C31)O
InChI
InChI=1S/C19H21NO/c1-20-12-6-11-16-15-8-3-2-7-14(15)13-19(21)18-10-5-4-9-17(16)18/h2-5,7-11,19-21H,6,12-13H2,1H3/b16-11+
InChIKey
VAGXZGJKNUNLHK-LFIBNONCSA-N
Chemical Structure
2D Structure
2D structure of 10-Hydroxynortriptyline, (E)-
CAS: 47132-16-1
CID: 6440567
Formula: C19H21NO
MW: 279.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight279.4
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass279.162314293
Monoisotopic Mass279.162314293
Topological Polar Surface Area32.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity365
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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