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(Q104945889)
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English
1-benzoyl-4,4,12-trimethyl-9,11-bis(3-methylbut-2-en-1-yl)-12-(4-methylpent-3-en-1-yl)-3-oxatricyclo[7.3.1.0²,⁷]trideca-2(7),5-diene-8,13-dione
group of stereoisomers with the chemical formula C₃₈H₄₈O₄
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
568.3552600159999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₈H₄₈O₄
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canonical SMILES
O=C(C=1C=CC=CC1)C23C(=O)C(C(=O)C=4C=CC(OC42)(C)C)(CC=C(C)C)CC(CC=C(C)C)C3(C)CCC=C(C)C
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Identifiers
InChI
InChI=1S/C38H48O4/c1-25(2)14-13-21-36(9)29(18-17-26(3)4)24-37(23-19-27(5)6)32(40)30-20-22-35(7,8)42-33(30)38(36,34(37)41)31(39)28-15-11-10-12-16-28/h10-12,14-17,19-20,22,29H,13,18,21,23-24H2,1-9H3
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InChIKey
BTVPHIYTBLEIHE-UHFFFAOYSA-N
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PubChem CID
85347779
1 reference
based on heuristic
inferred from InChIKey
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