Methyl 4,6-O-benzylidene-α-D-glucopyranoside (Q82932468)

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chemical compound

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Language	Label	Description	Also known as
English	Methyl 4,6-O-benzylidene-α-D-glucopyranoside	chemical compound

Statements

instance of

type of chemical entity

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subclass of

CTK8G1077

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based on heuristic

inferred from SMILES

chemical structure

Methyl-4,6-O-benzyliden-α-D-glucopyranosid.svg
209 × 132; 23 KB

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mass

282.110338296 dalton

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based on heuristic

inferred from InChI

chemical formula

C₁₄H₁₈O₆

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canonical SMILES

COC1OC2COC(c3ccccc3)OC2C(O)C1O

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based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C14H18O6/c1-17-14-11(16)10(15)12-9(19-14)7-18-13(20-12)8-5-3-2-4-6-8/h2-6,9-16H,7H2,1H3

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InChIKey

VVSWDMJYIDBTMV-UHFFFAOYSA-N

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CAS Registry Number

3162-96-7

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ChemSpider ID

558408

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PubChem CID

11822086

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102946

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matched by identifier from

InChIKey

InChIKey

VVSWDMJYIDBTMV-UHFFFAOYSA-N

UniChem compound ID

22956904

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stated in

UniChem

MassBank accession ID

MSBNK-Washington_State_Univ-BML80030

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MSBNK-Washington_State_Univ-BML80031

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MSBNK-Washington_State_Univ-BML80032

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DSSTox substance ID

DTXSID20953584

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DSSTOX compound identifier

DTXCID801009908

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NSC number

1681

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EC number

221-615-2

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ECHA Substance Infocard ID

100.019.651

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