(Q105297794)

English

[(4R,5S,8S,8aR)-3,8-dimethyl-2-oxo-5-prop-1-en-2-yl-4,5,6,7,8,8a-hexahydro-1H-azulen-4-yl] acetate

chemical compound

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Statements

type of chemical entity

0 references

3,8-dimethyl-2-oxo-5-(prop-1-en-2-yl)-4,5,6,7,8,8a-hexahydro-1H-azulen-4-yl acetate

1 reference

based on heuristic

inferred from SMILES

276.172544628 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₄O₃

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canonical SMILES

O=C(OC1C2=C(C(=O)CC2C(C)CCC1C(=C)C)C)C

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isomeric SMILES

C=C(C)[C@@H]1CC[C@H](C)[C@H]2CC(=O)C(C)=C2[C@@H]1OC(C)=O

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Pleocarphus revolutus

1 reference

New sesquiterpenes from Pleocarphus revolutus

Identifiers

InChI=1S/C17H24O3/c1-9(2)13-7-6-10(3)14-8-15(19)11(4)16(14)17(13)20-12(5)18/h10,13-14,17H,1,6-8H2,2-5H3/t10-,13-,14+,17+/m0/s1

0 references

VVQBDBJUDRAIIN-IHQJAULKSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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