Osthol

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Systematic / IUPAC Name: 7-Methoxy-8-(3-methyl-2-buten-1-yl)-2H-chromen-2-one

ID: Reference7618

Other Names: Ostol;
Ostole;
2H-1-Benzopyran-2-one, 7-methoxy-8-(3-methyl-2-butenyl)-;
7-Methoxy-8-(3-methyl-2-butenyl)coumarin;
7-Methoxy-8-(3-methylbut-2-en-1-yl)-2H-chromen-2-one ; more

Formula: C15H16O3

Spectral Data

Osthol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS ; Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 2
No. of Spectra 1874
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 3/22/2018 12:50:48 PM
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Identificators

InChI InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3
InChI Key MBRLOUHOWLUMFF-UHFFFAOYSA-N
Canonical SMILES CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)C
CAS 484128
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Other Names Ostol;
Ostole;
2H-1-Benzopyran-2-one, 7-methoxy-8-(3-methyl-2-butenyl)-;
7-Methoxy-8-(3-methyl-2-butenyl)coumarin;
7-Methoxy-8-(3-methylbut-2-en-1-yl)-2H-chromen-2-one;
7-Methoxy-8-(3-methylbut-2-enyl)-1-benzopyran-2-one;
7-Methoxy-8-(3-methylbut-2-enyl)chromen-2-one;
7-Methoxy-8-isopentenylcoumarin;
8-(3-Methyl-2-butenyl)herniarin;
Coumarin, 7-methoxy-8-(3-methyl-2-butenyl)-;
Osthole

In Other Databases

PubChem 10228
KEGG C09280
ChEMBL CHEMBL52229
ChEBI CHEBI:69832
ChemSpider 9811
Wikipedia Osthol
ChemIDPlus 000484128