(Q105344662)

English

Cannabisin D

chemical compound

cannabisin D
CHEMBL445592

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instance of

type of chemical entity

0 references

subclass of

7-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-N2,N3-bis(4-hydroxyphenethyl)-6-methoxy-1,2-dihydronaphthalene-2,3-dicarboxamide

1 reference

based on heuristic

inferred from SMILES

mass

624.247166112 dalton

1 reference

based on heuristic

inferred from SMILES

624.24716611 dalton

1 reference

stated in

PubChem

stereoisomer of

(1R,2R)-7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-N,3-N-bis[2-(4-hydroxyphenyl)ethyl]-6-methoxy-1,2-dihydronaphthalene-2,3-dicarboxamide

1 reference

1 reference

C₃₆H₃₆N₂O₈

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canonical SMILES

COC1=C(C=CC(=C1)C2C(C(=CC3=CC(=C(C=C23)O)OC)C(=O)NCCC4=CC=C(C=C4)O)C(=O)NCCC5=CC=C(C=C5)O)O

1 reference

stated in

PubChem

COc1cc(C2c3cc(O)c(OC)cc3C=C(C(=O)NCCc3ccc(O)cc3)C2C(=O)NCCc2ccc(O)cc2)ccc1O

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isomeric SMILES

COC1=C(C=CC(=C1)[C@H]2[C@@H](C(=CC3=CC(=C(C=C23)O)OC)C(=O)NCCC4=CC=C(C=C4)O)C(=O)NCCC5=CC=C(C=C5)O)O

1 reference

stated in

PubChem

COc1cc([C@@H]2c3cc(O)c(OC)cc3C=C(C(=O)NCCc3ccc(O)cc3)[C@H]2C(=O)NCCc2ccc(O)cc2)ccc1O

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found in taxon

Hyoscyamus niger

2 references

stated in

Lignanamides and nonalkaloidal components of Hyoscyamus niger seeds

stated in

Lignanamides and nonalkaloidal components of Hyoscyamus niger seeds

Cannabis sativa

1 reference

stated in

Three phenyldihydronaphthalene lignanamides from fruits of Cannabis sativa

Litsea hypophaea

1 reference

stated in

Secondary metabolites from the roots of Litsea hypophaea and their antitubercular activity

Identifiers

InChI

InChI=1S/C36H36N2O8/c1-45-31-18-23(7-12-29(31)41)33-27-20-30(42)32(46-2)19-24(27)17-28(35(43)37-15-13-21-3-8-25(39)9-4-21)34(33)36(44)38-16-14-22-5-10-26(40)11-6-22/h3-12,17-20,33-34,39-42H,13-16H2,1-2H3,(H,37,43)(H,38,44)/t33-,34-/m1/s1

1 reference

stated in

PubChem

InChIKey

XYTYRVFKBJENPE-KKLWWLSJSA-N

1 reference

2 references

17 September 2022

inferred from InChIKey

1 reference

1 reference

(Q105344662)

Cannabisin D

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Identifiers

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