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2D Structure
Also known as: 2-[4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]oxy-6-(hydroxymethyl)-5-methoxyoxane-3,4-diol, Cellulose gel, Schembl825024, Chebi:167997, Q80294
Molecular Formula
C14H26O11
Molecular Weight
370.35  g/mol
InChI Key
PTHCMJGKKRQCBF-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]oxy-6-(hydroxymethyl)-5-methoxyoxane-3,4-diol
2.1.2 InChI
InChI=1S/C14H26O11/c1-21-11-5(3-15)24-14(10(20)7(11)17)25-12-6(4-16)23-13(22-2)9(19)8(12)18/h5-20H,3-4H2,1-2H3
2.1.3 InChI Key
PTHCMJGKKRQCBF-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1C(OC(C(C1O)O)OC2C(OC(C(C2O)O)OC)CO)CO
2.2 Synonyms
2.2.1 MeSH Synonyms

1. Avicel Ph-101

2. Cephere

3. Ethispheres250

4. Microcrystalline Cellulose

5. Pharmacel 101

2.2.2 Depositor-Supplied Synonyms

1. 2-[4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]oxy-6-(hydroxymethyl)-5-methoxyoxane-3,4-diol

2. Cellulose Gel

3. Schembl825024

4. Chebi:167997

5. Q80294

2.3 Create Date
2007-02-09
3 Chemical and Physical Properties
Molecular Weight 370.35 g/mol
Molecular Formula C14H26O11
XLogP3-4.2
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Exact Mass370.14751164 g/mol
Monoisotopic Mass370.14751164 g/mol
Topological Polar Surface Area168 Ų
Heavy Atom Count25
Formal Charge0
Complexity410
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count10
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Excipients

Usually inert substances added to a prescription in order to provide suitable consistency to the dosage form. These include binders, matrix, base or diluent in pills, tablets, creams, salves, etc. (See all compounds classified as Excipients.)