Sophocarpine monohydrate

Basic Information

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CAS Number

145572-44-7

Molecular Formula

C15H24N2O2

Molecular Weight

264.37 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

Melting Point

No data available

Boiling Point

425.4±45.0 °C at 760 mmHg

Density

1.1900

Flash Point

194.0±21.1 °C

Refractive Index

1.603

SMILES

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O=C1C=CC[C@]2([H])[C@@]3([H])CCCN4[C@@]3([H])[C@](CCC4)([H])CN21.[H]O[H]

InChI

InChI=1S/C15H22N2O.H2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14;/h1,7,11-13,15H,2-6,8-10H2;1H2/t11-,12+,13+,15-;/m0./s1

InChIKey

FBOREIYHDGYUFA-PUILLJIJSA-N

LogP

0.823

Topological Polar Surface Area

55.050000000000004 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

392

Synonyms & References

English

13,14-Didehydromatridin-15-one
SOPHOCARPINE
(6AS,11AR,11BR,11CS)-2,3,5,6,6A,7,11,11A,11B,11C-DECAHYDRO-1H,4H-3A,7A-DIAZA-BENZO[DE]ANTHRACEN-8-ONE
Matridine-13-ene-15-one
Sophocarpine Monohydrate
(41S,7aS,13aR,13bR)-2,3,41,6,7,7a,8,13,13a,13b-Decahydro-1H,5H,10H-dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10-one hydrate
13,14-Didehydromatridin-15-one Monohydrate
(-)-Sophocarpine
C15H22N2O
sophocarpine-monohydrate
13,14-Didehydromatrine
MLS006011788
AAGFPTSOPGCENQ-JLNYLFASSA-N
s2405
STK801894
BBL029727
RL01831
NCGC0016
13,14-didehydromatridin-15-one
Sophocarpine monohydrate

MDL Number

MFCD26960838

FAQ

What is Sophocarpine monohydrate (CAS: 145572-44-7)?

Sophocarpine monohydrate (CAS: 145572-44-7) is a quinolizidine alkaloid derivative with the chemical formula C15H21NO4·H2O. It is a white crystalline solid known for its anticholinergic and antispasmodic properties, commonly used in pharmaceutical research. The compound exhibits solubility in water and ethanol, with a melting point around 150–155°C. Its structure includes a pyridine ring and a hydroxyl group, contributing to its pharmacological activity.

What are the main uses of Sophocarpine monohydrate (CAS: 145572-44-7)?

Sophocarpine monohydrate (CAS: 145572-44-7) is primarily used in pharmaceuticals as a research compound for its potential antitumor, anti-inflammatory, and antiviral effects. It also finds applications in traditional medicine for treating spasms and gastrointestinal disorders. In scientific research, it serves as a tool for studying alkaloid mechanisms and drug development. Its use in food or industrial sectors is limited due to low bioavailability and specific handling requirements.

Is Sophocarpine monohydrate (CAS: 145572-44-7) safe?

Sophocarpine monohydrate (CAS: 145572-44-7) is generally considered safe when used in controlled pharmaceutical or research settings. However, it may cause mild side effects like gastrointestinal discomfort if misused. Safety guidelines recommend avoiding inhalation, skin contact, and ingestion without proper protective measures. Regulatory standards emphasize handling under fume hoods and adhering to safety protocols to minimize risks.

How should Sophocarpine monohydrate (CAS: 145572-44-7) be stored?

Sophocarpine monohydrate (CAS: 145572-44-7) should be stored in a cool, dry place (below 25°C), away from moisture and light. Keep in a sealed, airtight container to maintain stability and prevent degradation. It is recommended to store in a well-ventilated area and avoid exposure to incompatible substances. Proper storage ensures optimal shelf life and maintains its chemical integrity for research or pharmaceutical use.