(Q105271769)

English

(5aR,8aR,9S)-9-(1,3-benzodioxol-4-yl)-4-methoxy-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

arylnaphthalene-type lignan

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mass

382.105252916 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₁₈O₇

0 references

canonical SMILES

O=C1OCC2CC3=C(OC)C=4OCOC4C=C3C(C=5C=CC=C6OCOC65)C12

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isomeric SMILES

COc1c2c(cc3c1OCO3)[C@@H](c1cccc3c1OCO3)[C@H]1C(=O)OC[C@@H]1C2

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found in taxon

Bursera graveolens

1 reference

stated in

A new and known cytotoxic aryltetralin-type lignans from stems of Bursera graveolens

Identifiers

InChI

InChI=1S/C21H18O7/c1-23-19-13-5-10-7-24-21(22)16(10)17(12(13)6-15-20(19)28-9-26-15)11-3-2-4-14-18(11)27-8-25-14/h2-4,6,10,16-17H,5,7-9H2,1H3/t10-,16-,17+/m0/s1

0 references

InChIKey

UFEZQYFXESTBRQ-PZDALLCQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UFEZQYFXESTBRQ-PZDALLCQSA-N

(Q105271769)

(5aR,8aR,9S)-9-(1,3-benzodioxol-4-yl)-4-methoxy-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one

Statements

Identifiers

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