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KUHISTANOL-B;3-(6',7'-DIHYDRO-6',7'-DIHYDROXY-FARNESYL)-PARA-HYDROXY-BENZOIC-ACID
SpectraBase Compound ID B14xDgAzadM
InChI InChI=1S/C22H32O5/c1-15(2)6-5-13-22(4,27)20(24)12-8-16(3)7-9-17-14-18(21(25)26)10-11-19(17)23/h6-7,10-11,14,20,23-24,27H,5,8-9,12-13H2,1-4H3,(H,25,26)/b16-7+
InChIKey JXAFVRIAOQJYNY-FRKPEAEDSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AaPNA2jGSml
Name Kuhistanol B
Alternate Name(s) 3-[(2E)-6,7-dihydroxy-3,7,11-trimethyl-dodeca-2,10-dienyl]-4-hydroxy-benzoic acid 4-Oxidanyl-3-[(2E)-3,7,11-trimethyl-6,7-bis(oxidanyl)dodeca-2,10-dienyl]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-15(2)6-5-13-22(4,27)20(24)12-8-16(3)7-9-17-14-18(21(25)26)10-11-19(17)23/h6-7,10-11,14,20,23-24,27H,5,8-9,12-13H2,1-4H3,(H,25,26)/b16-7+
InChIKey JXAFVRIAOQJYNY-FRKPEAEDSA-N
Molecular Weight 376.493 g/mol
SMILES Oc1ccc(cc1C\C=C\(CCC(C(CCC=C(C)C)(C)O)O)C)C(=O)O
SPLASH splash10-0pw9-7960000000-e10cf39cefe875882568
Source of Spectrum G4-63-365-2
Wiley ID 1608301