(Q104923693)

English

5-(9-hydroxy-7,8-dimethyl-3-oxo-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-7-yl)-3-methylpentanoic acid

group of stereoisomers with the chemical formula C₂₀H₃₀O₅

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Statements

group of stereoisomers

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clerodane diterpenoid

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clerodane diterpenoid

350.2093240599999 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₅

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canonical SMILES

O=C1OCC23C1=CCCC2C(C)(CCC(C)CC(=O)O)C(C)C(O)C3

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Identifiers

InChI=1S/C20H30O5/c1-12(9-17(22)23)7-8-19(3)13(2)15(21)10-20-11-25-18(24)14(20)5-4-6-16(19)20/h5,12-13,15-16,21H,4,6-11H2,1-3H3,(H,22,23)

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BCXBTOCJMISERO-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

BCXBTOCJMISERO-UHFFFAOYSA-N

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