Altenuene

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Systematic / IUPAC Name: (2S,3S,4aS)-2,3,7-Trihydroxy-9-methoxy-4a-methyl-2,3,4,4a-tetrahydro-6H-benzo[c]chromen-6-one

ID: Reference7709

Other Names: (2S,3S,4aS)-2,3,7-Trihydroxy-9-methoxy-4a-methyl-2H,3H,4H,4aH,6H-benzo[c]chromen-6-one

Formula: C15H16O6

Spectral Data

Altenuene 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
No. of Spectral Trees 1
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 4/5/2018 11:22:02 AM
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Identificators

InChI InChI=1S/C15H16O6/c1-15-6-12(18)10(16)5-9(15)8-3-7(20-2)4-11(17)13(8)14(19)21-15/h3-5,10,12,16-18H,6H2,1-2H3/t10-,12-,15-/m0/s1
InChI Key MMHTXEATDNFMMY-WBIUFABUSA-N
Canonical SMILES CC12CC(C(C=C1C3=CC(=CC(=C3C(=O)O2)O)OC)O)O
CAS
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Other Names (2S,3S,4aS)-2,3,7-Trihydroxy-9-methoxy-4a-methyl-2H,3H,4H,4aH,6H-benzo[c]chromen-6-one

In Other Databases

PubChem 34687
ChEMBL CHEMBL482228
ChemSpider 31922
ChemIDPlus 029752430