(Q104966349)

English

(3a,4-Dihydroxy-4-methyl-1-methylidene-8-oxo-7-propan-2-yl-2,3,5,6,7,8a-hexahydroazulen-5-yl) 2-methylbut-2-enoate

group of stereoisomers with the chemical formula C₂₀H₃₀O₅

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instance of

group of stereoisomers

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subclass of

guaiane sesquiterpenoid

1 reference

inferred from

guaiane sesquiterpenoid

mass

350.20932406 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₅

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canonical SMILES

O=C(OC1CC(C(=O)C2C(=C)CCC2(O)C1(O)C)C(C)C)C(=CC)C

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Identifiers

InChI

InChI=1S/C20H30O5/c1-7-12(4)18(22)25-15-10-14(11(2)3)17(21)16-13(5)8-9-20(16,24)19(15,6)23/h7,11,14-16,23-24H,5,8-10H2,1-4,6H3

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InChIKey

CNUDIHDLCLICBI-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CNUDIHDLCLICBI-UHFFFAOYSA-N

(Q104966349)

(3a,4-Dihydroxy-4-methyl-1-methylidene-8-oxo-7-propan-2-yl-2,3,5,6,7,8a-hexahydroazulen-5-yl) 2-methylbut-2-enoate

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Identifiers

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