(Q105158557)

English

(3S,3aR,4S,7R,10E,11aR)-7-hydroperoxy-4-hydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

chemical compound

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instance of

type of chemical entity

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subclass of

7-Hydroperoxy-4-hydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

282.146723804 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,3aR,4S,7S,10E,11aR)-7-hydroperoxy-4-hydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

(3S,3aR,4S,7R,10E,11aS)-7-hydroperoxy-4-hydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₅

0 references

canonical SMILES

O=C1OC2C=C(C)CCC(OO)C(=C)CC(O)C2C1C

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isomeric SMILES

C=C1C[C@H](O)[C@H]2[C@H](C)C(=O)O[C@@H]2/C=C(\C)CC[C@H]1OO

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found in taxon

Artemisia barrelieri

1 reference

stated in

Sesquiterpene lactones fromArtemisia barrelieri

Artemisia herba-alba

1 reference

stated in

Sesquiterpene lactones from Artemisia herba-alba subsp. Herba-alba

Identifiers

InChI

InChI=1S/C15H22O5/c1-8-4-5-12(20-18)9(2)7-11(16)14-10(3)15(17)19-13(14)6-8/h6,10-14,16,18H,2,4-5,7H2,1,3H3/b8-6+/t10-,11-,12+,13+,14+/m0/s1

0 references

InChIKey

LWSOHBJCUUXYPK-BQEVQKMQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LWSOHBJCUUXYPK-BQEVQKMQSA-N

(Q105158557)

(3S,3aR,4S,7R,10E,11aR)-7-hydroperoxy-4-hydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one

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Identifiers

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