(Q105322461)

English

[9-(5-Hydroxy-3-methylpentyl)-9,12-dimethyl-3-oxo-2-oxatricyclo[6.3.1.04,12]dodec-4-en-10-yl]methyl acetate

group of stereoisomers with the chemical formula C₂₂H₃₄O₅

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Statements

group of stereoisomers

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clerodane diterpenoid

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clerodane diterpenoid

378.24062418799986 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₄O₅

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canonical SMILES

O=C1OC2CC(COC(=O)C)C(C)(CCC(C)CCO)C3CCC=C1C23C

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Identifiers

InChI=1S/C22H34O5/c1-14(9-11-23)8-10-21(3)16(13-26-15(2)24)12-19-22(4)17(20(25)27-19)6-5-7-18(21)22/h6,14,16,18-19,23H,5,7-13H2,1-4H3

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WYOXTCVCVJIEPG-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

WYOXTCVCVJIEPG-UHFFFAOYSA-N

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