(Q105123376)

English

5,6,8a-trimethyl-3-(2-methylbutanoyloxy)-5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid

group of stereoisomers with the chemical formula C₂₅H₃₆O₆

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Statements

group of stereoisomers

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clerodane diterpenoid

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clerodane diterpenoid

432.25118887199983 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₅H₃₆O₆

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canonical SMILES

O=C1OCC(=C1)CCC2(C)C(C)CCC3(C(=CC(OC(=O)C(C)CC)CC32)C(=O)O)C

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Identifiers

InChI=1S/C25H36O6/c1-6-15(2)23(29)31-18-12-19(22(27)28)25(5)9-7-16(3)24(4,20(25)13-18)10-8-17-11-21(26)30-14-17/h11-12,15-16,18,20H,6-10,13-14H2,1-5H3,(H,27,28)

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IZQKVMZQVWVMJA-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

IZQKVMZQVWVMJA-UHFFFAOYSA-N

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