Isotaxiresinol

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Catalog Number ACM26194570
Product Name Isotaxiresinol
CAS Number 26194-57-0
Structure Isotaxiresinol
IUPAC Name 4-[(1S,2R,3R)-7-hydroxy-2,3-bis(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]benzene-1,2-diol
Synonyms 2,3-Naphthalenedimethanol, 1-(3,4-dihydroxyphenyl)-1,2,3,4-tetrahydro-7-hydroxy-6-methoxy-, (1S,2R,3R)-
Molecular Weight 346.38
Molecular Formula C19H22O6
Canonical SMILES COC1=C(C=C2C(C(C(CC2=C1)CO)CO)C3=CC(=C(C=C3)O)O)O
Inchi InChI=1S/C19H22O6/c1-25-18-6-11-4-12(8-20)14(9-21)19(13(11)7-17(18)24)10-2-3-15(22)16(23)5-10/h2-3,5-7,12,14,19-24H,4,8-9H2,1H3/t12-,14-,19-/m0/s1
InChIKey GQLVRVYXAHDDLB-PJFSTRORSA-N
Boiling Point 607.5±55.0 °C
Melting Point 171 °C
Purity 98%
Density 1.348±0.06 g/ml
Appearance Powder

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