(Q105025489)

English

9-(1,3-benzodioxol-5-yl)-4-[4-hydroxy-4-(hydroxymethyl)-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxolan-2-yl]oxy-6,7-dimethoxy-3H-benzo[f][2]benzofuran-1-one

group of stereoisomers with the chemical formula C₃₁H₃₂O₁₅

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Statements

instance of

group of stereoisomers

0 references

subclass of

arylnaphthalene-type lignan

1 reference

inferred from

arylnaphthalene-type lignan

mass

644.174120324 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₃₂O₁₅

0 references

canonical SMILES

O=C1OCC=2C(OC3OCC(O)(CO)C3OC4OCC(O)C(O)C4O)=C5C=C(OC)C(OC)=CC5=C(C=6C=CC=7OCOC7C6)C12

0 references

found in taxon

Justicia procumbens

1 reference

stated in

DNA strand-scission by phloroglucinols and lignans from heartwood of Garcinia subelliptica Merr. and Justicia plants.

Identifiers

InChI

InChI=1S/C31H32O15/c1-38-19-6-14-15(7-20(19)39-2)26(16-8-40-28(36)23(16)22(14)13-3-4-18-21(5-13)44-12-43-18)45-30-27(31(37,10-32)11-42-30)46-29-25(35)24(34)17(33)9-41-29/h3-7,17,24-25,27,29-30,32-35,37H,8-12H2,1-2H3

0 references

InChIKey

HBUCXSOGVZJQHH-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HBUCXSOGVZJQHH-UHFFFAOYSA-N

(Q105025489)

9-(1,3-benzodioxol-5-yl)-4-[4-hydroxy-4-(hydroxymethyl)-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxolan-2-yl]oxy-6,7-dimethoxy-3H-benzo[f][2]benzofuran-1-one

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Identifiers

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