(Q27137670)

CHEBI:69328 (English)

7 October 2016

chemical formula

C₁₆H₂₂O₅

1 reference

CHEBI:69328 (English)

7 October 2016

canonical SMILES

CC1CC2C(C(C3(C1C(CC3=O)OC)C)O)C(=C)C(=O)O2

1 reference

CHEBI:69328 (English)

7 October 2016

isomeric SMILES

C[C@@H]1C[C@H]2[C@H]([C@@H]([C@]3([C@H]1[C@@H](CC3=O)OC)C)O)C(=C)C(=O)O2

1 reference

Pseudoguaianolides and guaianolides from Inula hupehensis as potential anti-inflammatory agents

CHEBI:69328 (English)

7 October 2016

1 reference

Identifiers

InChI

InChI=1S/C16H22O5/c1-7-5-9-12(8(2)15(19)21-9)14(18)16(3)11(17)6-10(20-4)13(7)16/h7,9-10,12-14,18H,2,5-6H2,1,3-4H3/t7-,9+,10-,12-,13-,14+,16-/m1/s1

1 reference

CHEBI:69328 (English)

7 October 2016

2 references

CHEBI:69328 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

2 references

(1S,2R,5R,6S,7S,8S,10R)-6-hydroxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide (English)

7 October 2016

https://commonchemistry.cas.org/detail?cas_rn=1333396-70-5

10 April 2021

1 reference

(3aS,4S,4aR,7R,7aS,8R,9aS)-4-Hydroxy-7-methoxy-4a,8-dimethyl-3-methylenedecahydroazuleno[6,5-b]furan-2,5-dione (English)

7 October 2016

2 references

CHEBI:69328 (English)

matched by identifier from

7 October 2016

Reaxys registry number

21902553

1 reference

(1S,2R,5R,6S,7S,8S,10R)-6-hydroxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide (English)

7 October 2016

ChEBI ID

69328

mapping relation type

2 references

(1S,2R,5R,6S,7S,8S,10R)-6-hydroxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C16H22O5/c1-7-5-9-12(8(2)15(19)21-9)14(18)16(3)11(17)6-10(20-4)13(7)16/h7,9-10,12-14,18H,2,5-6H2,1,3-4H3/t7-,9+,10-,12-,13-,14+,16-/m1/s1

1 reference

matched by identifier from

CHEMBL1911131 (English)

7 October 2016

1 reference

1 reference