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NIGROLINEAXANTHONE_T;1,5,6-TRIHYDROXY-3-METHOXY-4-(3-HYDROXY-3-METHYLBUTYL)-XANTHONE
SpectraBase Compound ID 2ZJBwFrn1fV
InChI InChI=1S/C19H20O7/c1-19(2,24)7-6-9-13(25-3)8-12(21)14-15(22)10-4-5-11(20)16(23)18(10)26-17(9)14/h4-5,8,20-21,23-24H,6-7H2,1-3H3
InChIKey KWHHTRSOMASIJT-UHFFFAOYSA-N
Mol Weight 360.36 g/mol
Molecular Formula C19H20O7
Exact Mass 360.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HL0U61YP9ul
Name Nigrolineaxanthone T
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O7
InChI InChI=1S/C19H20O7/c1-19(2,24)7-6-9-13(25-3)8-12(21)14-15(22)10-4-5-11(20)16(23)18(10)26-17(9)14/h4-5,8,20-21,23-24H,6-7H2,1-3H3
InChIKey KWHHTRSOMASIJT-UHFFFAOYSA-N
Molecular Weight 360.362 g/mol
SMILES Oc1ccc2c(Oc3c(c(cc(c3CCC(O)(C)C)OC)O)C2=O)c1O
SPLASH splash10-000i-0091000000-437cd20a2283e5db5046
Source of Spectrum X2-68-1220-4
Synonyms 1,5,6-trihydroxy-4-(3-hydroxy-3-methyl-butyl)-3-methoxy-xanthen-9-one 1,5,6-trihydroxy-4-(3-hydroxy-3-methyl-butyl)-3-methoxy-xanthone 1,5,6-trihydroxy-4-(3-hydroxy-3-methylbutyl)-3-methoxy-9-xanthenone 3-Methoxy-4-(3-methyl-3-oxidanyl-butyl)-1,5,6-tris(oxidanyl)xanthen-9-one
Wiley ID 1609650