(Q105327927)

English

[(1S,7R,10R,11S)-11-(acetyloxymethyl)-10,11-dimethyl-3-oxo-4-tricyclo[5.3.1.01,5]undec-4-enyl]methyl acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[11-(Acetyloxymethyl)-10,11-dimethyl-3-oxo-4-tricyclo[5.3.1.01,5]undec-4-enyl]methyl acetate

1 reference

based on heuristic

inferred from SMILES

mass

334.178023932 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₆O₅

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canonical SMILES

O=C(OCC=1C(=O)CC23C1CC(CCC2C)C3(C)COC(=O)C)C

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isomeric SMILES

CC(=O)OCC1=C2C[C@H]3CC[C@@H](C)[C@]2(CC1=O)[C@@]3(C)COC(C)=O

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found in taxon

Hedlundia hybrida

1 reference

stated in

Isocedrene derivatives and other sesquiterpenes from moscharia pinnatifida

Moscharia pinnatifida

1 reference

stated in

Isocedrene derivatives and other sesquiterpenes from moscharia pinnatifida

Identifiers

InChI

InChI=1S/C19H26O5/c1-11-5-6-14-7-16-15(9-23-12(2)20)17(22)8-19(11,16)18(14,4)10-24-13(3)21/h11,14H,5-10H2,1-4H3/t11-,14-,18+,19+/m1/s1

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InChIKey

XGYOGKCULAUKGU-JKTDROMQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XGYOGKCULAUKGU-JKTDROMQSA-N

(Q105327927)

[(1S,7R,10R,11S)-11-(acetyloxymethyl)-10,11-dimethyl-3-oxo-4-tricyclo[5.3.1.01,5]undec-4-enyl]methyl acetate

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Identifiers

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