(Q27137657)

CHEMBL1821988 (English)

7 October 2016

chemical formula

C₂₂H₂₄O₄

1 reference

CHEMBL1821988 (English)

7 October 2016

canonical SMILES

C1C2C3C=CC(C2C(=O)O)C4C3C1C4CCCC5=CC6=C(C=C5)OCO6

1 reference

CHEMBL1821988 (English)

7 October 2016

isomeric SMILES

C1[C@H]2[C@H]3C=C[C@H]([C@@H]2C(=O)O)[C@H]4[C@@H]3[C@@H]1[C@@H]4CCCC5=CC6=C(C=C5)OCO6

1 reference

CHEMBL1821988 (English)

Anti-inflammatory endiandric acid analogues from the roots of Beilschmiedia tsangii

7 October 2016

found in taxon

Beilschmiedia tsangii

1 reference

stated in

Identifiers

InChI

InChI=1S/C22H24O4/c23-22(24)21-14-6-5-13-16(21)9-15-12(19(14)20(13)15)3-1-2-11-4-7-17-18(8-11)26-10-25-17/h4-8,12-16,19-21H,1-3,9-10H2,(H,23,24)/t12-,13+,14-,15-,16-,19-,20-,21-/m0/s1

1 reference

CHEMBL1821988 (English)

SMOQNODVPACIFX-CZWRZWPQSA-N

7 October 2016

InChIKey

2 references

CHEMBL1821988 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(1R,2R,3R,4S,5S,7S,8R,9S)-4-[3-(1,3-Benzodioxol-5-yl)propyl]tetracyclo[5.4.0.0~2,5~.0~3,9~]undec-10-ene-8-carboxylic acid (English)

7 October 2016

2 references

CHEMBL1821988 (English)

matched by identifier from

7 October 2016

InChIKey

SMOQNODVPACIFX-CZWRZWPQSA-N

ChEBI ID

69316

mapping relation type

2 references

endiandric acid K, rel- (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C22H24O4/c23-22(24)21-14-6-5-13-16(21)9-15-12(19(14)20(13)15)3-1-2-11-4-7-17-18(8-11)26-10-25-17/h4-8,12-16,19-21H,1-3,9-10H2,(H,23,24)/t12-,13+,14-,15-,16-,19-,20-,21-/m0/s1

1 reference