(Q104968126)

English

[16-Acetyloxy-2-hydroxy-14-(methoxymethyl)-5,5,9-trimethyl-15-oxo-8-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

group of stereoisomers with the chemical formula C₂₅H₃₈O₇

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Statements

group of stereoisomers

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kaurane diterpenoid

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kaurane diterpenoid

450.566 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₅H₃₈O₇

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canonical SMILES

O=C(OC1CCC(C)(C)C2CC(O)C34C(=O)C(COC)C(CCC3C12C)C4OC(=O)C)C

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Identifiers

InChI=1S/C25H38O7/c1-13(26)31-20-9-10-23(3,4)18-11-19(28)25-17(24(18,20)5)8-7-15(22(25)32-14(2)27)16(12-30-6)21(25)29/h15-20,22,28H,7-12H2,1-6H3

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CQMCCBFTGIIXMG-UHFFFAOYSA-N

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1 reference

based on heuristic

inferred from InChIKey

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