(Q105349703)

English

(2E)-6-[(acetyloxy)methyl]-11-hydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6-dien-8-yl 2-methylprop-2-enoate

group of stereoisomers with the chemical formula C₂₁H₂₆O₈

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Statements

group of stereoisomers

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germacrane sesquiterpenoid

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germacrane sesquiterpenoid

406.16276779199995 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₆O₈

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canonical SMILES

O=C1OC2=CC3(OC(O)(CC3)C(C)CC(OC(=O)C(=C)C)C2=C1COC(=O)C)C

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isomeric SMILES

C=C(C)C(=O)OC1CC(C)C2(O)CCC(C)(/C=C3/OC(=O)C(COC(C)=O)=C31)O2

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Identifiers

InChI=1S/C21H26O8/c1-11(2)18(23)27-15-8-12(3)21(25)7-6-20(5,29-21)9-16-17(15)14(19(24)28-16)10-26-13(4)22/h9,12,15,25H,1,6-8,10H2,2-5H3/b16-9+

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YKIDGUZXBGGNBZ-CXUHLZMHSA-N

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1 reference

matched by identifier from

YKIDGUZXBGGNBZ-CXUHLZMHSA-N

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