(Q104987561)

English

Grossamide

group of stereoisomers with the chemical formula C₃₆H₃₆N₂O₈

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Statements

group of stereoisomers

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phenethylamine alkaloid

1 reference

phenethylamine alkaloid

biogenic benzofuran

1 reference

biogenic benzofuran

624.247166112 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₃₆N₂O₈

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canonical SMILES

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

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isomeric SMILES

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

1 reference

based on heuristic

inferred from InChI

Capsicum annuum

1 reference

Phenolic compounds from the roots of Solanaceae plants. A new lignan amide, grossamide, from bell pepper (Capsicum annuum var. grossum)

Identifiers

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)/b14-7+

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DROXVBRNXCRUHP-VGOFMYFVSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

DROXVBRNXCRUHP-VGOFMYFVSA-N

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