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(Q103818154)
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English
27-Hydroxy-17-(1-hydroxyethyl)-5,13,25-trimethylspiro[2,10,16,23-tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa-4,12,18,20-tetraene-26,2'-oxirane]-11,22-dione
group of stereoisomers with the chemical formula C₂₉H₃₈O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
trichothecane sesquiterpenoid
1 reference
inferred from
trichothecane sesquiterpenoid
macrolides
1 reference
inferred from
macrolides
mass
530.2515827959998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₃₈O₉
0 references
canonical SMILES
O=C1OCC23CCC(=CC3OC4C(O)C(OC(=O)C=CC=CC(OCCC(=C1)C)C(O)C)C2(C)C54OC5)C
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Identifiers
InChI
InChI=1S/C29H38O9/c1-17-9-11-28-15-35-23(32)14-18(2)10-12-34-20(19(3)30)7-5-6-8-22(31)38-25-24(33)26(37-21(28)13-17)29(16-36-29)27(25,28)4/h5-8,13-14,19-21,24-26,30,33H,9-12,15-16H2,1-4H3
0 references
InChIKey
CXUYRNDRKDXIHC-UHFFFAOYSA-N
0 references
PubChem CID
73077327
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CXUYRNDRKDXIHC-UHFFFAOYSA-N
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