(Q82997353)

English

3-Formyl-2a-hydroxy-6,6,7b-trimethyl-2,2a,4a,5,6,7,7a,7b-octahydro-1H-cyclobuta[e]inden-2-yl 2,4-dihydroxy-6-methylbenzoate

chemical compound

In more languages

Statements

type of chemical entity

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illudane sesquiterpenoid

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400.18858861599983 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₃H₂₈O₆

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canonical SMILES

O=CC1=CC2CC(C)(C)CC2C3(C)CC(OC(=O)C=4C(O)=CC(O)=CC4C)C13O

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Identifiers

InChI=1S/C23H28O6/c1-12-5-15(25)7-17(26)19(12)20(27)29-18-10-22(4)16-9-21(2,3)8-13(16)6-14(11-24)23(18,22)28/h5-7,11,13,16,18,25-26,28H,8-10H2,1-4H3

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SJZRUQOYQZRISL-UHFFFAOYSA-N

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CAS Registry Number

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1 reference

based on heuristic

inferred from InChIKey

UniChem compound ID

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DSSTox substance ID

DTXSID601002982

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DSSTOX compound identifier

DTXCID201429910

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Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

SJZRUQOYQZRISL-UHFFFAOYSA-N

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