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Oxireno[5',6']benzo[1',2':4,5]cyclodeca[1,2-b]furan-3-ol, 1a,2,3,3a,4,12,12a,12b-octahydro-3a,7,11,12b-tetramethyl-, acetate, [1aS-(1aR*,3R*,3aS*,5Z,7Z,12aS*,12bS*)]-
SpectraBase Compound ID FolHl7B2Rya
InChI InChI=1S/C22H28O4/c1-13-7-6-8-21(4)18(10-16-14(2)12-24-17(16)9-13)22(5)20(26-22)11-19(21)25-15(3)23/h6-7,9,12,18-20H,8,10-11H2,1-5H3/b7-6-,13-9-/t18-,19+,20+,21-,22-/m1/s1
InChIKey KAZVTCAXTYKXHH-NDJXVVRVSA-N
Mol Weight 356.46 g/mol
Molecular Formula C22H28O4
Exact Mass 356.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5oQSalOJSZR
Name Oxireno[5',6']benzo[1',2':4,5]cyclodeca[1,2-b]furan-3-ol, 1a,2,3,3a,4,12,12a,12b-octahydro-3a,7,11,12b-tetramethyl-, acetate, [1aS-(1aR*,3R*,3aS*,5Z,7Z,12aS*,12bS*)]-
Alternate Name(s) (-)-(8aR,9S,11S,12R,12aR,4Z,6Z)-11,12-Epoxy-8,8a,9,10,11,12,12a,13-octahydro-1,5,8a,12-tetramethylbenzo[4,5]cyclodeca[1,2-b]furan-9-yl acetate (-)-Verecynarmin A (1R,8Z,10Z,13R,14S,16S,18R)-4,9,13,18-tetramethyl-6,17-dioxatetracyclo[11.5.0.0(3,7).0(16,18)]octadeca-3(7),4,8,10-tetraen-14-yl acetate
CAS Registry Number 110600-68-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O4
InChI InChI=1S/C22H28O4/c1-13-7-6-8-21(4)18(10-16-14(2)12-24-17(16)9-13)22(5)20(26-22)11-19(21)25-15(3)23/h6-7,9,12,18-20H,8,10-11H2,1-5H3/b7-6-,13-9-/t18-,19+,20+,21-,22-/m1/s1
InChIKey KAZVTCAXTYKXHH-NDJXVVRVSA-N
Molecular Weight 356.462 g/mol
SMILES [C@]12(O[C@]2(C[C@@]([C@]2([C@]1(Cc1c(occ1C)\C=C\(C)\C=C/C2)[H])C)(OC(=O)C)[H])[H])C
SPLASH splash10-06xt-0910000000-0f3761a29151b8abdd83
Source of Spectrum H-70-989-1
Wiley ID 1346053