(Q104949164)

English

[(1R,2R,7S,8aR)-1,8a-dimethyl-6-oxo-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydronaphthalen-2-yl] (E)-3-methylpent-2-enoate

chemical compound

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No description defined

Statements

type of chemical entity

0 references

(1,8a-Dimethyl-6-oxo-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydronaphthalen-2-yl) 3-methylpent-2-enoate

1 reference

based on heuristic

inferred from SMILES

330.21949482 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₃₀O₃

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canonical SMILES

O=C(OC1CCC2=CC(=O)C(C(=C)C)CC2(C)C1C)C=C(C)CC

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isomeric SMILES

C=C(C)[C@@H]1C[C@@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C(\C)CC)[C@@H]2C

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Hoehnephytum imbricatum

1 reference

A petasol deravative from Hoehnephytum imbricatum

Identifiers

InChI=1S/C21H30O3/c1-7-14(4)10-20(23)24-19-9-8-16-11-18(22)17(13(2)3)12-21(16,6)15(19)5/h10-11,15,17,19H,2,7-9,12H2,1,3-6H3/b14-10+/t15-,17-,19+,21+/m0/s1

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BYDUDGIJBAXSFD-CGPAVOAVSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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