Tanshinone IIA

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Systematic / IUPAC Name: 1,6,6-Trimethyl-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione

ID: Reference5848

Other Names: Dan Shen ketone ;
Tanshinon II;
Tanshinone 2-A;
Tanshinone A;
Tanshinone B ; more

Formula: C19H18O3

Class: Endogenous Metabolites

Spectral Data

Tanshinone IIA 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 Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/27/2016 11:43:02 AM
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Identificators

InChI InChI=1S/C19H18O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,2)3)15(12)17(21)16(20)14(10)18/h6-7,9H,4-5,8H2,1-3H3
InChI Key HYXITZLLTYIPOF-UHFFFAOYSA-N
Canonical SMILES CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C
CAS 568729
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Other Names Dan Shen ketone ;
Tanshinon II;
Tanshinone 2-A;
Tanshinone A;
Tanshinone B;
Tanshinone II;
1,6,6-Trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione;
1,6,6-Trimethyl-8,9-dihydro-7H-naphtho[1,2-g]benzofuran-10,11-dione;
1,6,6-Trimethyl-8,9-dihydro-7H-naphtho[1,2-g]benzofuran-10,11-quinone;
1,6,6-Trimethyl-8,9-dihydro-7H-naphtho[8,7-g]benzofuran-10,11-dione;
Phenanthro[1,2-b]furan-10,11-dione, 6,7,8,9-tetrahydro-1,6,6-trimethyl-;
NSC 686518 ;
NSC 686519 ;
TSA

In Other Databases

ChEMBL CHEMBL187266
PubChem 164676
ChEBI CHEBI:108595
ChemSpider 144362
ChemIDPlus 000568729; 092202523