(Q105196534)

English

(3S)-3beta,6alpha,9aalpha-Trimethyl-4alpha-acetoxy-6,6abeta,9alpha-trihydroxy-2,3,3abeta,4,5,6,6a,9,9a,9bbeta-decahydroazuleno[4,5-b]furan-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

pseudoguaiane sesquiterpenoid

1 reference

based on heuristic

inferred from SMILES

mass

340.152203108 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₄O₇

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canonical SMILES

O=C(OC1CC(O)(C)C2(O)C=CC(O)C2(C)C3OC(=O)C(C)C13)C

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isomeric SMILES

CC(=O)O[C@@H]1C[C@@](C)(O)[C@]2(O)C=C[C@H](O)[C@@]2(C)[C@@H]2OC(=O)[C@@H](C)[C@H]12

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found in taxon

Parthenium hysterophorus

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stated in

A new highly oxygenated pseudoguaianolide from a collection of the flowers of Parthenium hysterophorus

Identifiers

InChI

InChI=1S/C17H24O7/c1-8-12-10(23-9(2)18)7-15(3,21)17(22)6-5-11(19)16(17,4)13(12)24-14(8)20/h5-6,8,10-13,19,21-22H,7H2,1-4H3/t8-,10+,11-,12+,13+,15+,16-,17+/m0/s1

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InChIKey

OPRXYCSDSGOXEZ-RCRRSPMWSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OPRXYCSDSGOXEZ-RCRRSPMWSA-N

1 reference

(Q105196534)

(3S)-3beta,6alpha,9aalpha-Trimethyl-4alpha-acetoxy-6,6abeta,9alpha-trihydroxy-2,3,3abeta,4,5,6,6a,9,9a,9bbeta-decahydroazuleno[4,5-b]furan-2-one

Statements

Identifiers

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