(Q104987559)

English

2-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-5-[3-[2-(4-hydroxyphenyl)ethylamino]-3-oxoprop-1-enyl]-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide

group of stereoisomers with the chemical formula C₃₆H₃₆N₂O₈

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No description defined

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Statements

instance of

group of stereoisomers

0 references

subclass of

phenethylamine alkaloid

1 reference

inferred from

phenethylamine alkaloid

1 reference

624.2471661120001 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₆H₃₆N₂O₈

0 references

canonical SMILES

COc1cc(C2Oc3c(OC)cc(C=CC(=O)NCCc4ccc(O)cc4)cc3C2C(=O)NCCc2ccc(O)cc2)ccc1O

0 references

found in taxon

Cannabis

1 reference

stated in

Cannabisin A, an arylnaphthalene lignanamide from fruits of Cannabis sativa

Cannabis sativa

2 references

stated in

Three acyclic bis-phenylpropane lignanamides from fruits of Cannabis sativa

stated in

Three phenyldihydronaphthalene lignanamides from fruits of Cannabis sativa

potato

1 reference

stated in

Characterization of cross-linked hydroxycinnamic acid amides isolated from potato common scab lesions

Identifiers

InChI

InChI=1S/C36H36N2O8/c1-44-30-21-25(8-13-29(30)41)34-33(36(43)38-18-16-23-5-11-27(40)12-6-23)28-19-24(20-31(45-2)35(28)46-34)7-14-32(42)37-17-15-22-3-9-26(39)10-4-22/h3-14,19-21,33-34,39-41H,15-18H2,1-2H3,(H,37,42)(H,38,43)

0 references

InChIKey

DROXVBRNXCRUHP-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DROXVBRNXCRUHP-UHFFFAOYSA-N

ChEBI ID

182825

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C36H36N2O8/c1-44-30-21-25(8-13-29(30)41)34-33(36(43)38-18-16-23-5-11-27(40)12-6-23)28-19-24(20-31(45-2)35(28)46-34)7-14-32(42)37-17-15-22-3-9-26(39)10-4-22/h3-14,19-21,33-34,39-41H,15-18H2,1-2H3,(H,37,42)(H,38,43)

1 reference

MassBank accession ID

MSBNK-RIKEN-PR309392

1 reference

InChIKey

DROXVBRNXCRUHP-UHFFFAOYSA-N

stated in

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

1 reference

DROXVBRNXCRUHP-UHFFFAOYSA-N

stated in

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

1 reference

DROXVBRNXCRUHP-UHFFFAOYSA-N

stated in

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

1 reference

DROXVBRNXCRUHP-UHFFFAOYSA-N

stated in

MassBank/MassBank-data: release version 2022.06 to wikidata

retrieved

4 September 2022

based on heuristic

InChIKey match

(Q104987559)

2-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-5-[3-[2-(4-hydroxyphenyl)ethylamino]-3-oxoprop-1-enyl]-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide

Statements

Identifiers

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