(Q104984875)

English

[(1S,2R,4S,5R,9S,10S,11R)-2-hydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,12,13-trioxatetracyclo[9.2.2.01,10.05,9]pentadec-14-en-4-yl] acetate

chemical compound

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instance of

type of chemical entity

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subclass of

(2-Hydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,12,13-trioxatetracyclo[9.2.2.01,10.05,9]pentadec-14-en-4-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

336.12090298 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₀O₇

0 references

canonical SMILES

O=C1OC2C(C1=C)C(OC(=O)C)CC(O)(C)C34OOC(C=C3)(C)C24

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isomeric SMILES

C=C1C(=O)O[C@@H]2[C@@H]3[C@@]4(C=C[C@@]3(C)OO4)[C@](C)(O)C[C@H](OC(C)=O)[C@@H]12

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found in taxon

Artemisia montana

1 reference

stated in

Studies on Sesquiterpene Lactones. XIII. : Chemical Constituents of Artemisia montana(NAKAI)PAMP.

Identifiers

InChI

InChI=1S/C17H20O7/c1-8-11-10(21-9(2)18)7-16(4,20)17-6-5-15(3,23-24-17)13(17)12(11)22-14(8)19/h5-6,10-13,20H,1,7H2,2-4H3/t10-,11+,12-,13-,15+,16+,17-/m0/s1

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InChIKey

DLYNLFNMERBQKG-GWMRQPHLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DLYNLFNMERBQKG-GWMRQPHLSA-N

(Q104984875)

[(1S,2R,4S,5R,9S,10S,11R)-2-hydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,12,13-trioxatetracyclo[9.2.2.01,10.05,9]pentadec-14-en-4-yl] acetate

Statements

Identifiers

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