(Q27137683)

CHEBI:69341 (English)

[(3aS,5aS,8R,8aS,9R,9aS)-8-hydroxy-5,8-dimethyl-1-methylidene-2-oxo-5a,6,7,8a,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-9-yl] acetate

7 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₂O₅

1 reference

CHEBI:69341 (English)

7 October 2016

canonical SMILES

CC1=CC2C(C(C3C1CCC3(C)O)OC(=O)C)C(=C)C(=O)O2

1 reference

CHEBI:69341 (English)

7 October 2016

isomeric SMILES

CC1=C[C@H]2[C@H]([C@@H]([C@@H]3[C@@H]1CC[C@@]3(C)O)OC(=O)C)C(=C)C(=O)O2

1 reference

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

CHEBI:69341 (English)

7 October 2016

1 reference

Rhanteriopsis bombycina

1 reference

stated in

A seco-guaianolide and other sesquiterpene lactones from Postia bombycina

Identifiers

InChI

InChI=1S/C17H22O5/c1-8-7-12-13(9(2)16(19)22-12)15(21-10(3)18)14-11(8)5-6-17(14,4)20/h7,11-15,20H,2,5-6H2,1,3-4H3/t11-,12+,13-,14+,15+,17-/m1/s1

1 reference

CHEBI:69341 (English)

PLSCGWSBZMOKAA-RURKYGKJSA-N

7 October 2016

InChIKey

2 references

CHEBI:69341 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(3aR,4S,4aS,5R,7aS,9aS)-5-Hydroxy-5,8-dimethyl-3-methylene-2-oxo-2,3,3a,4,4a,5,6,7,7a,9a-decahydroazuleno[6,5-b]furan-4-yl acetate (English)

7 October 2016

2 references

CHEBI:69341 (English)

matched by identifier from

7 October 2016

InChIKey

PLSCGWSBZMOKAA-RURKYGKJSA-N

ChEBI ID

69341

mapping relation type

2 references

6alpha-acetoxyisoinuviscolide (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C17H22O5/c1-8-7-12-13(9(2)16(19)22-12)15(21-10(3)18)14-11(8)5-6-17(14,4)20/h7,11-15,20H,2,5-6H2,1,3-4H3/t11-,12+,13-,14+,15+,17-/m1/s1

1 reference