(Q105131406)

English

7-[2-(2-methoxy-5-oxo-2H-furan-3-yl)ethyl]-7,8-dimethyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one

group of stereoisomers with the chemical formula C₂₇H₃₈O₁₁

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Statements

instance of

group of stereoisomers

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subclass of

clerodane diterpenoid

1 reference

inferred from

clerodane diterpenoid

mass

538.241412036 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₃₈O₁₁

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canonical SMILES

O=C1OC(OC)C(=C1)CCC2(C)C(C)CCC34C(=CC(OC5OC(CO)C(O)C(O)C5O)CC32)C(=O)OC4

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found in taxon

Salvia

1 reference

stated in

α-Glucosidase Inhibitors from Salvia circinata.

Salvia officinalis

1 reference

stated in

α-Glucosidase Inhibitors from Salvia circinata.

Identifiers

InChI

InChI=1S/C27H38O11/c1-13-4-7-27-12-35-23(33)16(27)9-15(36-25-22(32)21(31)20(30)17(11-28)37-25)10-18(27)26(13,2)6-5-14-8-19(29)38-24(14)34-3/h8-9,13,15,17-18,20-22,24-25,28,30-32H,4-7,10-12H2,1-3H3

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InChIKey

JMHINZPNTWTGKC-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JMHINZPNTWTGKC-UHFFFAOYSA-N

(Q105131406)

7-[2-(2-methoxy-5-oxo-2H-furan-3-yl)ethyl]-7,8-dimethyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-3-one

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Identifiers

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