3-Hydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.02,15 04,13 06,11]henicosa-2(15),3,6,8,10,13-hexaen-5-one

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Systematic / IUPAC Name: 3-Hydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.02,15 04,13 06,11]henicosa-2(15),3,6,8,10,13-hexaen-5-one

ID: Reference7665

Other Names: 2,6-Epoxy-2H,8H-oxocino[3,2-b]xanthen-8-one, 3,4,5,6-tetrahydro-7-hydroxy-9,14-dimethoxy-2-methyl-

Formula: C21H20O7

Spectral Data

3-Hydroxy-7,14-dimethoxy-17-methyl-12,16,21-trioxapentacyclo[15.3.1.02,15 04,13 06,11]henicosa-2(15),3,6,8,10,13-hexaen-5-one 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 3/29/2018 11:38:06 AM
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Identificators

InChI InChI=1S/C21H20O7/c1-21-9-5-8-12(27-21)14-17(23)15-16(22)13-10(24-2)6-4-7-11(13)26-18(15)20(25-3)19(14)28-21/h4,6-7,12,23H,5,8-9H2,1-3H3
InChI Key YNDFKLFQXINGHN-UHFFFAOYSA-N
Canonical SMILES CC12CCCC(O1)C3=C(C4=C(C(=C3O2)OC)OC5=C(C4=O)C(=CC=C5)OC)O
CAS
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Other Names 2,6-Epoxy-2H,8H-oxocino[3,2-b]xanthen-8-one, 3,4,5,6-tetrahydro-7-hydroxy-9,14-dimethoxy-2-methyl-

In Other Databases

ChemSpider 22943178
PubChem 45782774