(Q105202446)

English

3-[2-(1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)ethenyl]-2-hydroxy-2H-furan-5-one

group of stereoisomers with the chemical formula C₂₀H₂₈O₃

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instance of

group of stereoisomers

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subclass of

clerodane diterpenoid

1 reference

inferred from

clerodane diterpenoid

mass

316.203844756 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₈O₃

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canonical SMILES

O=C1OC(O)C(C=CC2(C)C(C)CCC3(C(=CCCC23)C)C)=C1

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Identifiers

InChI

InChI=1S/C20H28O3/c1-13-6-5-7-16-19(13,3)10-8-14(2)20(16,4)11-9-15-12-17(21)23-18(15)22/h6,9,11-12,14,16,18,22H,5,7-8,10H2,1-4H3

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InChIKey

OXAFASQBBRNFES-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OXAFASQBBRNFES-UHFFFAOYSA-N

(Q105202446)

3-[2-(1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)ethenyl]-2-hydroxy-2H-furan-5-one

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Identifiers

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