(Q104992189)

English

5-[3-(Hydroxymethyl)-5-(3-hydroxyprop-1-enyl)-4-methoxy-2,3-dihydro-1-benzofuran-6-yl]penta-1,4-diene-1-sulfonic acid

group of stereoisomers with the chemical formula C₁₈H₂₂O₇S

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Statements

group of stereoisomers

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biogenic benzofuran

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biogenic benzofuran

382.4299 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₂O₇S

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canonical SMILES

O=S(=O)(O)C=CCC=CC1=CC=2OCC(C2C(OC)=C1C=CCO)CO

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Identifiers

InChI=1S/C18H22O7S/c1-24-18-15(7-5-8-19)13(6-3-2-4-9-26(21,22)23)10-16-17(18)14(11-20)12-25-16/h3-7,9-10,14,19-20H,2,8,11-12H2,1H3,(H,21,22,23)

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FADQOBMTUJMAHP-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

FADQOBMTUJMAHP-UHFFFAOYSA-N

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