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SARCOPHYTONOLIDE_E

View entire compound with spectra: 1 NMR, and 1 MS (GC)

SARCOPHYTONOLIDE_E
SpectraBase Compound ID 9e5n3wJmmwL
InChI InChI=1S/C20H32O3/c1-13(2)18-9-8-14(3)6-5-7-15(4)10-17(21)11-16-12-19(18)23-20(16)22/h6,12-13,15,17-19,21H,5,7-11H2,1-4H3/b14-6+/t15-,17-,18-,19+/m0/s1
InChIKey ZHOQSUGYUQVEER-MXPJZEDJSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jn0fqerblq
Name Sarcophytonolide E
Alternate Name(s) (1S,2S,5E,9S,11S)-11-hydroxy-5,9-dimethyl-2-propan-2-yl-15-oxabicyclo[11.2.1]hexadeca-5,13(16)-dien-14-one (1S,2S,5E,9S,11S)-5,9-dimethyl-11-oxidanyl-2-propan-2-yl-15-oxabicyclo[11.2.1]hexadeca-5,13(16)-dien-14-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-13(2)18-9-8-14(3)6-5-7-15(4)10-17(21)11-16-12-19(18)23-20(16)22/h6,12-13,15,17-19,21H,5,7-11H2,1-4H3/b14-6+/t15-,17-,18-,19+/m0/s1
InChIKey ZHOQSUGYUQVEER-MXPJZEDJSA-N
Molecular Weight 320.473 g/mol
SMILES O[C@@]1(CC=2C(O[C@](C2)([C@@](CC\C(=C\CC[C@@](C1)(C)[H])C)(C(C)C)[H])[H])=O)[H]
SPLASH splash10-0aos-9531000000-fdf7647807d8783aeb23
Source of Spectrum G4-69-822-1
Wiley ID 1694314