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Ophiocerin D
SpectraBase Compound ID 92EhOmhSeBj
InChI InChI=1S/C10H16O5/c1-3-4-8(12)15-10-6(2)14-5-7(11)9(10)13/h3-4,6-7,9-11,13H,5H2,1-2H3/b4-3-/t6-,7+,9-,10+/m1/s1
InChIKey ZKDAKCXDTRJOGZ-QENWWAFGSA-N
Mol Weight 216.23 g/mol
Molecular Formula C10H16O5
Exact Mass 216.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 80CYUyIA37P
Name Ophiocerin D
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O5
InChI InChI=1S/C10H16O5/c1-3-4-8(12)15-10-6(2)14-5-7(11)9(10)13/h3-4,6-7,9-11,13H,5H2,1-2H3/b4-3-/t6-,7+,9-,10+/m1/s1
InChIKey ZKDAKCXDTRJOGZ-QENWWAFGSA-N
Molecular Weight 216.233 g/mol
SMILES O[C@]1(CO[C@@]([C@@]([C@@]1(O)[H])(OC(\C=C/C)=O)[H])(C)[H])[H]
SPLASH splash10-014i-9000000000-600b5953caaf1dbc7a09
Source of Spectrum X2-68-704-4
Synonyms (Z)-2-butenoic acid [(2R,3R,4R,5S)-4,5-dihydroxy-2-methyl-3-oxanyl] ester [(2R,3R,4R,5S)-4,5-dihydroxy-2-methyloxan-3-yl] (Z)-but-2-enoate [(2R,3R,4R,5S)-4,5-dihydroxy-2-methyl-tetrahydropyran-3-yl] (Z)-but-2-enoate [(2R,3R,4R,5S)-2-methyl-4,5-bis(oxidanyl)oxan-3-yl] (Z)-but-2-enoate
Wiley ID 1609526