(Q105112664)

English

[(3aS,4R,4aS,8R,8aR,9aS)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-4-yl] acetate

chemical compound

In more languages

Statements

type of chemical entity

0 references

8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-octahydronaphtho[2,3-b]furan-4-yl acetate

1 reference

based on heuristic

inferred from SMILES

[(3aS,4R,8R,8aR,9aS)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-4-yl] acetate

1 reference

based on heuristic

inferred from SMILES

306.146723804 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3Ar,4r,4as,8r,8ar,9as)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxododecahydronaphtho[2,3-b]furan-4-yl acetate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₂O₅

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canonical SMILES

O=C1OC2CC3(C)C(O)CCC(=C)C3C(OC(=O)C)C2C1=C

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isomeric SMILES

C=C1C(=O)O[C@H]2C[C@]3(C)[C@H](C(=C)CC[C@H]3O)[C@@H](OC(C)=O)[C@@H]12

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Gonospermum gomerae

1 reference

Sesquiterpene lactones from Gonospermum gomerae and G. fruticosum and their cytotoxic activities

Identifiers

InChI=1S/C17H22O5/c1-8-5-6-12(19)17(4)7-11-13(9(2)16(20)22-11)15(14(8)17)21-10(3)18/h11-15,19H,1-2,5-7H2,3-4H3/t11-,12+,13-,14+,15-,17-/m0/s1

0 references

IGJIZPZJCAPPBP-UZVBGSJOSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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