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(+-)-Calanolide C
SpectraBase Compound ID 6Rc6kwfrgTv
InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12+,18-/m1/s1
InChIKey NIDRYBLTWYFCFV-FTLABTOESA-N
Mol Weight 370.45 g/mol
Molecular Formula C22H26O5
Exact Mass 370.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CAKNIcySIYl
Name (+-)-12.beta.-Hydroxy-6,6,10.beta.,11.beta.-tetramethyl-4-propyl-2H,6H,12H-10,11-dihydrobenzo[1,2-b:3,4-b':5,6-b"]tripyran-2-one
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Formula C22H26O5
InChI InChI=1S/C22H26O5/c1-6-7-13-10-15(23)26-21-16(13)20-14(8-9-22(4,5)27-20)19-17(21)18(24)11(2)12(3)25-19/h8-12,18,24H,6-7H2,1-5H3/t11-,12+,18-/m1/s1
InChIKey NIDRYBLTWYFCFV-FTLABTOESA-N
Molecular Weight 370.445 g/mol
SMILES O[C@]1(c2c(c3C=CC(Oc3c3c2OC(C=C3CCC)=O)(C)C)O[C@]([C@]1(C)[H])(C)[H])[H]
SPLASH splash10-0a4r-0029000000-e10d7ffe12425689482f
Source of Spectrum KC-0-3149-25
Synonyms (+-)-12.beta.-Hydroxy-6,6,10.beta.,11.beta.-tetramethyl-4-propyl-2H,6H,12H-10,11-dihydrobenzo[1,2-b:3,4-b':5,6-b'']tripyran-2-one
Wiley ID 784660