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(Q104982070)
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English
5-[3-(acetyloxy)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid
group of stereoisomers with the chemical formula C₂₂H₃₄O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
clerodane diterpenoid
1 reference
inferred from
clerodane diterpenoid
mass
362.2457095679999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₃₄O₄
0 references
canonical SMILES
O=C(O)C=C(C)CCC1(C)C(C)C(OC(=O)C)CC2(C(=CCCC21)C)C
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Identifiers
InChI
InChI=1S/C22H34O4/c1-14(12-20(24)25)10-11-21(5)16(3)18(26-17(4)23)13-22(6)15(2)8-7-9-19(21)22/h8,12,16,18-19H,7,9-11,13H2,1-6H3,(H,24,25)
0 references
InChIKey
DJEUHRRTZPCWNH-UHFFFAOYSA-N
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PubChem CID
85387092
1 reference
matched by identifier from
InChIKey
InChIKey
DJEUHRRTZPCWNH-UHFFFAOYSA-N
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