SDF/Mol File of Cornstarch (C27H48O20)
Identification of Cornstarch Chemical Compound
Chemical Formula | C27H48O20 |
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Molecular Weight | 692.65802 g/mol |
IUPAC Name | 5-[(5-{[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}methyl)-3,4-dihydroxyoxan-2-yl)oxy]-6-(hydroxymethyl)-2-methyloxane-3,4-diol |
SMILES String | COC4C(CO)OC(OCC2OC(OC1C(CO)OC(C)C(O)C1O)C(O)C(O)C2OC3OC(CO)C(OC)C(O)C3O)C(O)C4O |
InChI | InChI=1S/C27H48O20/c1-8-13(31)14(32)23(11(6-30)42-8)46-27-20(38)17(35)24(47-26-19(37)16(34)22(40-3)10(5-29)44-26)12(45-27)7-41-25-18(36)15(33)21(39-2)9(4-28)43-25/h8-38H,4-7H2,1-3H3 |
InChIKey | YJISHJVIRFPGGN-UHFFFAOYSA-N |
Structure Data File (SDF/MOL File) Description
The structure data file (SDF/MOL File) of Cornstarch 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 Cornstarch 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.
Search Another SDF·MOL File
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- Name: ethanol
- 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 Cornstarch Molecule
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Chemical structure of Cornstarch
By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of Cornstarch is available in chemical structure page of Cornstarch, 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 Cornstarch
The molecular weight of Cornstarch is available in molecular weight page of Cornstarch, 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 Cornstarch
The chemical formula of Cornstarch is given in chemical formula page of Cornstarch, 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 Cornstarch
An alternative way of expressing structural information in text format is InChI. The full standard InChI of Cornstarch is:
InChI=1S/C27H48O20/c1-8-13(31)14(32)23(11(6-30)42-8)46-27-20(38)17(35)24(47-26-19(37)16(34)22(40-3)10(5-29)44-26)12(45-27)7-41-25-18(36)15(33)21(39-2)9(4-28)43-25/h8-38H,4-7H2,1-3H3
It can provide a standard way to encode the molecular information of Cornstarch 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 Cornstarch is:
InChIKey=YJISHJVIRFPGGN-UHFFFAOYSA-N
The InChIKey may allow easier web searches for Cornstarch, but it needs to be linked to the full InChI to get back to the original structure of the Cornstarch since the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of Cornstarch
The Cornstarch compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of Cornstarch including the registry numbers are listed below, if available:
- CPC 6448
- CPC 3005
- HRW 13
- Sta-RX 1500
- Claro 5591
- Wheat starch, unmodified
- Aquapel (polysaccharide)
- OK PRE-GEL
- Food starch, unmodified
- ARGO brand corn starch
- Starch, pregelatinized
- Amaizo W 13
- Farinex 100
- Starch [USAN]
- Penford Gum 380
- Staramic 747
- W-Gum
- W-13 Stabilizer
- Starch, unmodified
- Starch, converted
- Starch, rice
- Starch, corn
- Starch, wheat
- Amylomaize VII
- Starch, potato
- Remyline Ac
- Galactasol A
- Arrowroot starch
- Wheat starch
- Starch dust
- Sorghum gum
- Sago starch
- Rice starch
- Food starch
- Corn starch
- Tapioca starch
- Tapon
- Starch mucilage
- Amyla
- Trogum
- Meluna
- Genvis
- Amylum
- Starken
- Melojel
- Maranta
- Maizena
- Keestar
- Clearjel
- Cornstarch
Cornstarch Identification Summary Frequently Asked Questions (FAQs)
What’s the Cornstarch formula? |
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C27H48O20 |
How many atoms and what elements are included in the Cornstarch molecule? |
95 atom(s) - 48 Hydrogen atom(s), 27 Carbon atom(s), and 20 Oxygen atom(s) |
How many chemical bonds and what kind of bonds are in the Cornstarch structure? |
98 bond(s) - 50 non-H bond(s), 12 rotatable bond(s), 4 six-membered ring(s), 11 hydroxyl group(s), 3 primary alcohol(s), 8 secondary alcohol(s), and 9 ether(s) (aliphatic) |
What’s the Cornstarch’s molar mass? |
692.65802 g/mol |
What’s the SMILES structure of Cornstarch? |
COC4C(CO)OC(OCC2OC(OC1C(CO)OC(C)C(O)C1O)C(O)C(O)C2OC3OC(CO)C(OC)C(O)C3O)C(O)C4O |
What’s the InChI code of Cornstarch? |
InChI=1S/C27H48O20/c1-8-13(31)14(32)23(11(6-30)42-8)46-27-20(38)17(35)24(47-26-19(37)16(34)22(40-3)10(5-29)44-26)12(45-27)7-41-25-18(36)15(33)21(39-2)9(4-28)43-25/h8-38H,4-7H2,1-3H3 |
What’s the InChIKey format of Cornstarch? |
YJISHJVIRFPGGN-UHFFFAOYSA-N |
1817
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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).