SDF/Mol File of Normelicopicine (C17H17NO5)
Identification of Normelicopicine Chemical Compound
| Chemical Formula | C17H17NO5 |
|---|---|
| Molecular Weight | 315.32058 g/mol |
| IUPAC Name | 1-hydroxy-2,3,4-trimethoxy-10-methyl-9,10-dihydroacridin-9-one |
| SMILES String | COc3c(OC)c(OC)c2n(C)c1ccccc1c(=O)c2c3O |
| InChI | InChI=1S/C17H17NO5/c1-18-10-8-6-5-7-9(10)13(19)11-12(18)15(21-2)17(23-4)16(22-3)14(11)20/h5-8,20H,1-4H3 |
| InChIKey | UGEKWKMLXLFVIY-UHFFFAOYSA-N |
Structure Data File (SDF/MOL File) Description
The structure data file (SDF/MOL File) of Normelicopicine is available for download. Click the link below to start downloading.
Download structure data file (SDF/MOL File)
The structure data file (SDF/MOL File) contains the information about the atoms, bonds, connectivity and coordinates of Normelicopicine molecule. It starts with a header block, followed by "connection table’, which describes the structural relationships and properties of the atoms.
The structure data file (SDF/MOL File) available above can be imported to most of the chemistry-related software packages, performing further scientific analysis. Most of the computational software and visualization program require the structural information of the target molecule, and the above structure data file (SDF/MOL File) can be a good option.
chemical table area
Search Another SDF·MOL File
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- CAS #: 64-17-5
- Formula: C2H5OH
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- InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
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Additional Information for Identifying Normelicopicine Molecule
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Chemical structure of Normelicopicine
By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of Normelicopicine is available in chemical structure page of Normelicopicine, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.
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Molecular weight of Normelicopicine
The molecular weight of Normelicopicine is available in molecular weight page of Normelicopicine, which is calculated as the sum of the atomic masses of each constituent element multiplied by the number of atoms of that element.
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Chemical formula of Normelicopicine
The chemical formula of Normelicopicine is given in chemical formula page of Normelicopicine, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.
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InChI (IUPAC International Chemical Identifier) information of Normelicopicine
An alternative way of expressing structural information in text format is InChI. The full standard InChI of Normelicopicine is:
InChI=1S/C17H17NO5/c1-18-10-8-6-5-7-9(10)13(19)11-12(18)15(21-2)17(23-4)16(22-3)14(11)20/h5-8,20H,1-4H3
It can provide a standard way to encode the molecular information of Normelicopicine to facilitate the search for the compound information in databases and on the web.
The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of Normelicopicine is:
InChIKey=UGEKWKMLXLFVIY-UHFFFAOYSA-N
The InChIKey may allow easier web searches for Normelicopicine, but it needs to be linked to the full InChI to get back to the original structure of the Normelicopicine since the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of Normelicopicine
The Normelicopicine compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of Normelicopicine including the registry numbers are listed below, if available:
- 1-Hydroxy-2,3,4-trimethoxy-10-methyl-9(10H)-acridinone #
- 1-Hydroxy-2,3,4-trimethoxy-10-methyl-9 -acridinone
- 1-hydroxy-2,3,4-trimethoxy-10-methylacridin-9-one
- 9(10H)-Acridinone, 1-hydroxy-2,3,4-trimethoxy-10-methyl-
- 9-Acridanone, 1-hydroxy-2,3,4-trimethoxy-10-methyl-
- O-Normelicopicine
- 7008-68-6
- Normelicopicine
Normelicopicine Identification Summary Frequently Asked Questions (FAQs)
| What’s the Normelicopicine formula? |
|---|
| C17H17NO5 |
| How many atoms and what elements are included in the Normelicopicine molecule? |
| 40 atom(s) - 17 Hydrogen atom(s), 17 Carbon atom(s), 1 Nitrogen atom(s), and 5 Oxygen atom(s) |
| How many chemical bonds and what kind of bonds are in the Normelicopicine structure? |
| 42 bond(s) - 25 non-H bond(s), 13 multiple bond(s), 3 rotatable bond(s), 1 double bond(s), 12 aromatic bond(s), 3 six-membered ring(s), 2 ten-membered ring(s), 1 ketone(s) (aromatic), 1 tertiary amine(s) (aromatic), 1 aromatic hydroxyl(s), and 3 ether(s) (aromatic) |
| What’s the Normelicopicine’s molar mass? |
| 315.32058 g/mol |
| What’s the SMILES structure of Normelicopicine? |
| COc3c(OC)c(OC)c2n(C)c1ccccc1c(=O)c2c3O |
| What’s the InChI code of Normelicopicine? |
| InChI=1S/C17H17NO5/c1-18-10-8-6-5-7-9(10)13(19)11-12(18)15(21-2)17(23-4)16(22-3)14(11)20/h5-8,20H,1-4H3 |
| What’s the InChIKey format of Normelicopicine? |
| UGEKWKMLXLFVIY-UHFFFAOYSA-N |
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Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN
technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).