(Q105327062)

English

[(3aR,4R,6Z,10E,11aS)-4-hydroxy-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-yl]methyl acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(4-Hydroxy-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-yl)methyl acetate

1 reference

based on heuristic

inferred from SMILES

mass

306.146723804 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

[(3aR,4S,6Z,10E,11aR)-4-hydroxy-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-yl]methyl acetate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₂O₅

0 references

canonical SMILES

O=C1OC2C=C(C)CCC=C(COC(=O)C)CC(O)C2C1=C

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isomeric SMILES

C=C1C(=O)O[C@H]2/C=C(\C)CC/C=C(\COC(C)=O)C[C@@H](O)[C@@H]12

0 references

found in taxon

Podanthus ovatifolius

1 reference

stated in

Sesquiterpene lactones from Podanthus ovatifolius

Identifiers

InChI

InChI=1S/C17H22O5/c1-10-5-4-6-13(9-21-12(3)18)8-14(19)16-11(2)17(20)22-15(16)7-10/h6-7,14-16,19H,2,4-5,8-9H2,1,3H3/b10-7+,13-6-/t14-,15+,16-/m1/s1

0 references

InChIKey

XFJQSSRNKXJHCG-JEBMRZLGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XFJQSSRNKXJHCG-JEBMRZLGSA-N

(Q105327062)

[(3aR,4R,6Z,10E,11aS)-4-hydroxy-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-6-yl]methyl acetate

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Identifiers

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