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5,9,11-Trihydroxy-6,8-diisopentyl-3,3-dimethyl-2,3-dihydropyrano[3,2-a]xanthen-12(1H)-one
SpectraBase Compound ID KgAzeSWX9qW
InChI InChI=1S/C28H36O6/c1-14(2)7-9-16-19(29)13-20(30)22-24(32)21-17-11-12-28(5,6)34-27(17)23(31)18(10-8-15(3)4)26(21)33-25(16)22/h13-15,29-31H,7-12H2,1-6H3
InChIKey LGIBPRSKKXFYGE-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C28H36O6
Exact Mass 468.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AypUdBautOd
Name 5,9,11-Trihydroxy-6,8-diisopentyl-3,3-dimethyl-2,3-dihydropyrano[3,2-a]xanthen-12(1H)-one
CAS Registry Number 62501-55-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H36O6
InChI InChI=1S/C28H36O6/c1-14(2)7-9-16-19(29)13-20(30)22-24(32)21-17-11-12-28(5,6)34-27(17)23(31)18(10-8-15(3)4)26(21)33-25(16)22/h13-15,29-31H,7-12H2,1-6H3
InChIKey LGIBPRSKKXFYGE-UHFFFAOYSA-N
Molecular Weight 468.590 g/mol
SMILES Oc1c(c2Oc3c(c4c(c(c3CCC(C)C)O)OC(CC4)(C)C)C(c2c(c1)O)=O)CCC(C)C
SPLASH splash10-0929-0013900000-cb8d45b0d9b53ab7b913
Source of Spectrum KC-1977-13-0
Synonyms Pyrano[3,2-a]xanthen-12(1H)-one, 2,3-dihydro-5,9,11-trihydroxy-3,3-dimethyl-6,8-bis(3-methylbutyl)-
Wiley ID 1392453