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(4aR,5S,8R,8aR,9aR)-4a,5,6,7,8,8a,9,9a-Octahydro-8,8a-dihydroxy-9a-methoxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one
SpectraBase Compound ID JxtxHRLE1Ao
InChI InChI=1S/C16H24O5/c1-9-5-6-12(17)15(19)8-16(20-4)11(7-14(9,15)3)10(2)13(18)21-16/h9,12,17,19H,5-8H2,1-4H3/t9-,12+,14+,15-,16+/m0/s1
InChIKey HFEHXSMUEOGVPQ-BRHOPSAPSA-N
Mol Weight 296.36 g/mol
Molecular Formula C16H24O5
Exact Mass 296.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IeJqYcexNve
Name (4aR,5S,8R,8aR,9aR)-4a,5,6,7,8,8a,9,9a-Octahydro-8,8a-dihydroxy-9a-methoxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O5
InChI InChI=1S/C16H24O5/c1-9-5-6-12(17)15(19)8-16(20-4)11(7-14(9,15)3)10(2)13(18)21-16/h9,12,17,19H,5-8H2,1-4H3/t9-,12+,14+,15-,16+/m0/s1
InChIKey HFEHXSMUEOGVPQ-BRHOPSAPSA-N
Literature Reference DOI 10.1002/cbdv.201100236
Molecular Weight 296.363 g/mol
SMILES O[C@]1([C@@]2([C@@]([C@](CC1)(C)[H])(CC1=C(C(O[C@@]1(C2)OC)=O)C)C)O)[H]
SPLASH splash10-0230-8940000000-019fe0332d5ca3d18408
Source of Spectrum CBD-9-638-1
Synonyms 1.beta.,10.alpha.-Dihydroxy-8.alpha.-methoxyeremophil-7(11)-en-12,8.beta.-olide (4aR,5S,8R,8aR,9aR)-8,8a-dihydroxy-9a-methoxy-3,4a,5-trimethyl-4a,5,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(4H)-one
Wiley ID 1771128