(Q83066758)

English

Deisopropylngaione

chemical compound

In more languages

Statements

type of chemical entity

0 references

1-[5-(furan-3-yl)-2-methyloxolan-2-yl]propan-2-one

1 reference

based on heuristic

inferred from SMILES

208.109944372 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

1-[(2R,5R)-5-(furan-3-yl)-2-methyloxolan-2-yl]propan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₂H₁₆O₃

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canonical SMILES

O=C(C)CC1(OC(C2=COC=C2)CC1)C

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isomeric SMILES

CC(=O)C[C@]1(CC[C@H](O1)C2=COC=C2)C

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Eremophila deserti

1 reference

Terpenoid chemistry. XXI. ( - )-Epingaione, ( - )-Dehydrongaione, ( - )-Dehydroepingaione, and ( - )-Deisopropylngaione, toxic furanoid sesquiterpenoid ketones from Myoporum deserti

Identifiers

InChI=1S/C12H16O3/c1-9(13)7-12(2)5-3-11(15-12)10-4-6-14-8-10/h4,6,8,11H,3,5,7H2,1-2H3/t11-,12+/m0/s1

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YKWSUSNJLLZKDK-NWDGAFQWSA-N

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CAS Registry Number

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1 reference

matched by identifier from

YKWSUSNJLLZKDK-NWDGAFQWSA-N

UniChem compound ID

1 reference

DSSTox substance ID

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matched by identifier from

YKWSUSNJLLZKDK-NWDGAFQWSA-N

DSSTOX compound identifier

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1 reference

matched by identifier from

YKWSUSNJLLZKDK-NWDGAFQWSA-N

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