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(Q104199704)
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English
methyl 7-[1-chloro-4-hydroxy-4-(oct-2-en-1-yl)-2-oxo-6-oxabicyclo[3.1.0]hexan-3-ylidene]hept-5-enoate
group of stereoisomers with the chemical formula C₂₁H₂₉ClO₅
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
396.1703517079999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₉ClO₅
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canonical SMILES
O=C(OC)CCCC=CC=C1C(=O)C2(Cl)OC2C1(O)CC=CCCCCC
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Identifiers
InChI
InChI=1S/C21H29ClO5/c1-3-4-5-6-9-12-15-20(25)16(18(24)21(22)19(20)27-21)13-10-7-8-11-14-17(23)26-2/h7,9-10,12-13,19,25H,3-6,8,11,14-15H2,1-2H3
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InChIKey
VQTGQBDTRZNQSB-UHFFFAOYSA-N
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PubChem CID
72772514
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VQTGQBDTRZNQSB-UHFFFAOYSA-N
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