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Details

Stereochemistry ABSOLUTE
Molecular Formula C8H13NO.ClH
Molecular Weight 175.656
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TROPINONE HYDROCHLORIDE

SMILES

Cl.CN1[C@H]2CC[C@@H]1CC(=O)C2

InChI

InChIKey=HUGYQXFQBHWMQD-UKMDXRBESA-N
InChI=1S/C8H13NO.ClH/c1-9-6-2-3-7(9)5-8(10)4-6;/h6-7H,2-5H2,1H3;1H/t6-,7+;

HIDE SMILES / InChI

Molecular Formula C8H13NO
Molecular Weight 139.1949
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Photochemical N-demethylation of alkaloids.
2001 Feb 26
Calystegines in Calystegia sepium derive from the tropane alkaloid pathway.
2001 Nov
Molecular cloning, expression and characterization of tropinone reductase II, an enzyme of the SDR family in Solanum tuberosum (L.).
2002 Feb 1
Enantioselective synthesis of S-(+)-2beta-carboalkoxy-3alpha-[bis(4-fluorophenyl)methoxy]tropanes as novel probes for the dopamine transporter.
2002 May 6
Biosynthesis of calystegines: 15N NMR and kinetics of formation in root cultures of Calystegia sepium.
2003 Feb
Synthesis and muscarinic activities of O-[(benzyl- or benzoyl-pyrazolyl)propynyl]-oximes of N-methylpiperidinone, 3-tropinone, and 3-quinuclidinone.
2003 May 15
Images in cardiovascular medicine. A rare form of midventricular Tako-Tsubo after emotional stress followed up with magnetic resonance imaging.
2006 Aug 15
Immunolocalisation of two tropinone reductases in potato (Solanum tuberosum L.) root, stolon, and tuber sprouts.
2006 Dec
Tropinone reductases, enzymes at the branch point of tropane alkaloid metabolism.
2006 Feb
Whole-genome analysis of the SHORT-ROOT developmental pathway in Arabidopsis.
2006 May
Calystegines in potatoes with genetically engineered carbohydrate metabolism.
2007
Highly stereoselective [4 + 3] cycloadditions of nitrogen-stabilized oxyallyl cations with pyrroles: an approach to parvineostemonine.
2007 Mar 29
Medium- and short-chain dehydrogenase/reductase gene and protein families : the SDR superfamily: functional and structural diversity within a family of metabolic and regulatory enzymes.
2008 Dec
Protein structure modeling indicates hexahistidine-tag interference with enzyme activity.
2008 Jul
Tropane alkaloids as medicinally useful natural products and their synthetic derivatives as new drugs.
2008 Jul-Aug
The functional divergence of short-chain dehydrogenases involved in tropinone reduction.
2008 May
An approach for synthesis of tropinone analogue N-substituted with triazine ring.
2008 Nov-Dec
Asymmetric synthesis of substituted tropinones using the intramolecular mannich cyclization reaction and acyclic N-sulfinyl beta-amino ketone ketals.
2009 Apr 2
Biogenetically inspired syntheses of alkaloid natural products.
2009 Nov
Molecular cloning and characterization of two tropinone reductases in Anisodus acutangulus and enhancement of tropane alkaloid production in AaTRI-transformed hairy roots.
2009 Oct 23
Engineering cofactor preference of ketone reducing biocatalysts: A mutagenesis study on a γ-diketone reductase from the yeast Saccharomyces cerevisiae serving as an example.
2010 Apr 14
A transcriptomic approach highlights induction of secondary metabolism in citrus fruit in response to Penicillium digitatum infection.
2010 Aug 31
N-Methyl stereochemistry in tropinone: the conformational flexibility of the tropane motif.
2010 Jun 21
Coronatine-insensitive 1 (COI1) mediates transcriptional responses of Arabidopsis thaliana to external potassium supply.
2010 Mar
Whole genome wide expression profiles of Vitis amurensis grape responding to downy mildew by using Solexa sequencing technology.
2010 Oct 28
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 18:02:14 GMT 2023
Edited
by admin
on Sat Dec 16 18:02:14 GMT 2023
Record UNII
YX7ATS8MQH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TROPINONE HYDROCHLORIDE
Common Name English
8-AZABICYCLO(3.2.1)OCTAN-3-ONE, 8-METHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
8-AZABICYCLO(3.2.1)OCTAN-3-ONE, 8-METHYL-, HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
CAS
4827-85-4
Created by admin on Sat Dec 16 18:02:14 GMT 2023 , Edited by admin on Sat Dec 16 18:02:14 GMT 2023
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FDA UNII
YX7ATS8MQH
Created by admin on Sat Dec 16 18:02:14 GMT 2023 , Edited by admin on Sat Dec 16 18:02:14 GMT 2023
PRIMARY
PUBCHEM
21126884
Created by admin on Sat Dec 16 18:02:14 GMT 2023 , Edited by admin on Sat Dec 16 18:02:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID00964037
Created by admin on Sat Dec 16 18:02:14 GMT 2023 , Edited by admin on Sat Dec 16 18:02:14 GMT 2023
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