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Methyl 16-R/S-hydroxy-cleroda-3,13(14)-Z-dien-15,16-olide
SpectraBase Compound ID Fg66mtR05ns
InChI InChI=1S/C22H32O4/c1-14-7-6-8-18-21(14,4)11-9-15(2)22(18,5)12-10-17-13-19(24)26-20(17)25-16(3)23/h7,13,15,18,20H,6,8-12H2,1-5H3/t15-,18+,20?,21+,22+/m1/s1
InChIKey RUWAXMSQGBJERD-DNDIUFHKSA-N
Mol Weight 360.5 g/mol
Molecular Formula C22H32O4
Exact Mass 360.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5G7Drjd2Uvd
Name Methyl 16-R/S-hydroxy-cleroda-3,13(14)-Z-dien-15,16-olide
Alternate Name(s) 3-{2-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenyl]ethyl}-5-oxo-2,5-dihydro-2-furanyl acetate P V-3A
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Formula C22H32O4
InChI InChI=1S/C22H32O4/c1-14-7-6-8-18-21(14,4)11-9-15(2)22(18,5)12-10-17-13-19(24)26-20(17)25-16(3)23/h7,13,15,18,20H,6,8-12H2,1-5H3/t15-,18+,20?,21+,22+/m1/s1
InChIKey RUWAXMSQGBJERD-DNDIUFHKSA-N
Molecular Weight 360.494 g/mol
SMILES [C@@]12([C@@]([C@](CCC=3C(OC(C3)=O)OC(=O)C)(C)[C@@](CC1)(C)[H])(CCC=C2C)[H])C
SPLASH splash10-0ac0-6910000000-1925bf7e23ceea489960
Source of Spectrum PS-1999-0-68
Wiley ID 1348570