(Q105351355)

English

[(1R,5S,6R,7S)-3-acetyloxy-6-(1,3-benzodioxol-5-yl)-5-methoxy-7-methyl-4-oxo-1-prop-2-enyl-8-bicyclo[3.2.1]oct-2-enyl] acetate

group of stereoisomers with the chemical formula C₂₄H₂₆O₈

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

442.162767792 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₂₆O₈

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canonical SMILES

O=C(OC1=CC2(CC=C)C(OC(=O)C)C(OC)(C1=O)C(C3=CC=C4OCOC4=C3)C2C)C

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isomeric SMILES

C=CC[C@@]12C=C(OC(C)=O)C(=O)[C@@](OC)(C1OC(C)=O)[C@@H](c1ccc3c(c1)OCO3)[C@@H]2C

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found in taxon

Ocotea catharinensis

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stated in

Neolignans from Ocotea catharinensis

stated in

Neolignans from Ocotea catharinensis

Identifiers

InChI

InChI=1S/C24H26O8/c1-6-9-23-11-19(31-14(3)25)21(27)24(28-5,22(23)32-15(4)26)20(13(23)2)16-7-8-17-18(10-16)30-12-29-17/h6-8,10-11,13,20,22H,1,9,12H2,2-5H3/t13-,20+,22?,23-,24+/m0/s1

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InChIKey

YOJOMKQXHBDBOK-IBPQCQHASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YOJOMKQXHBDBOK-IBPQCQHASA-N

(Q105351355)

[(1R,5S,6R,7S)-3-acetyloxy-6-(1,3-benzodioxol-5-yl)-5-methoxy-7-methyl-4-oxo-1-prop-2-enyl-8-bicyclo[3.2.1]oct-2-enyl] acetate

Statements

Identifiers

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