(Q105178223)

English

Bilagrewin

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

3-[2-(4-Hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl]prop-2-enal

1 reference

based on heuristic

inferred from SMILES

mass

402.131467664 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₂O₈

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canonical SMILES

O=CC=CC1=CC(OC)=C2OC(CO)C(OC2=C1)C3=CC(OC)=C(O)C(OC)=C3

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isomeric SMILES

COc1cc([C@@H]2Oc3cc(/C=C/C=O)cc(OC)c3O[C@H]2CO)cc(OC)c1O

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found in taxon

Grewia bilamellata

2 references

stated in

Antimalarial compounds from Grewia bilamellata.

stated in

Antimalarial compounds from Grewia bilamellata.

Zanthoxylum avicennae

2 references

stated in

Neolignans, a coumarinolignan, lignan derivatives, and a chromene: anti-inflammatory constituents from Zanthoxylum avicennae

stated in

Neolignans, a coumarinolignan, lignan derivatives, and a chromene: anti-inflammatory constituents from Zanthoxylum avicennae

Santalum album

2 references

stated in

Lignans from Santalum album and their cytotoxic activities

stated in

Lignans from Santalum album and their cytotoxic activities

Identifiers

InChI

InChI=1S/C21H22O8/c1-25-14-9-13(10-15(26-2)19(14)24)20-18(11-23)29-21-16(27-3)7-12(5-4-6-22)8-17(21)28-20/h4-10,18,20,23-24H,11H2,1-3H3/b5-4+/t18-,20-/m0/s1

0 references

InChIKey

NEVUVMGBMOQVHU-BJUCQYRTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NEVUVMGBMOQVHU-BJUCQYRTSA-N

1 reference

NMRShiftDB structure ID

10028046

1 reference

matched by identifier from

InChIKey

NEVUVMGBMOQVHU-BJUCQYRTSA-N

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