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2-Oxa-17,19-dihydroxyspongia-13(16),14-dien-3-one
SpectraBase Compound ID FpnFcwFbXiy
InChI InChI=1S/C19H26O5/c1-17(9-20)14-5-6-19(10-21)13-8-23-7-12(13)3-4-15(19)18(14,2)11-24-16(17)22/h7-8,14-15,20-21H,3-6,9-11H2,1-2H3/t14-,15+,17+,18-,19+/m0/s1
InChIKey ADPDJDKFIYGJPX-CSQLCUNESA-N
Mol Weight 334.41 g/mol
Molecular Formula C19H26O5
Exact Mass 334.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bk673f9jB7e
Name 2-Oxa-17,19-dihydroxyspongia-13(16),14-dien-3-one
CAS Registry Number 130574-80-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O5
InChI InChI=1S/C19H26O5/c1-17(9-20)14-5-6-19(10-21)13-8-23-7-12(13)3-4-15(19)18(14,2)11-24-16(17)22/h7-8,14-15,20-21H,3-6,9-11H2,1-2H3/t14-,15+,17+,18-,19+/m0/s1
InChIKey ADPDJDKFIYGJPX-CSQLCUNESA-N
Molecular Weight 334.412 g/mol
SMILES OC[C@]1(C(OC[C@@]2([C@]3(CCc4c([C@]3(CO)CC[C@@]12[H])coc4)[H])C)=O)C
SPLASH splash10-00di-0392000000-be3de08b8d4394137bb0
Source of Spectrum J-56-1153-5
Synonyms (3bS,5aR,6S,9aR,9bR)-3b,6-bis(hydroxymethyl)-6,9a-dimethyl-3b,4,5,5a,6,9,9a,9b,10,11-decahydro-7H-furo[3',4':5,6]naphtho[1,2-c]pyran-7-one
Wiley ID 1330984