(Q104993882)

English

(2R,3R,4S,5S,6R)-2-[(6-methyl-1-benzofuran-3-yl)methoxy]-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

chemical compound

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type of chemical entity

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subclass of

2-[(6-Methyl-1-benzofuran-3-yl)methoxy]-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

mass

456.163161716 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₈O₁₁

0 references

canonical SMILES

OC1COC(OCC2OC(OCC3=COC=4C=C(C=CC43)C)C(O)C(O)C2O)C(O)C1O

0 references

isomeric SMILES

Cc1ccc2c(CO[C@@H]3O[C@H](CO[C@@H]4OC[C@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)coc2c1

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found in taxon

Paeonia

1 reference

stated in

Monoterpene glycosides from Paeonia hybrida

Identifiers

InChI

InChI=1S/C21H28O11/c1-9-2-3-11-10(5-28-13(11)4-9)6-29-21-19(27)17(25)16(24)14(32-21)8-31-20-18(26)15(23)12(22)7-30-20/h2-5,12,14-27H,6-8H2,1H3/t12-,14+,15-,16+,17-,18+,19+,20-,21+/m0/s1

0 references

InChIKey

FDZSTHSCUBLQEZ-BUKODKCYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FDZSTHSCUBLQEZ-BUKODKCYSA-N

(Q104993882)

(2R,3R,4S,5S,6R)-2-[(6-methyl-1-benzofuran-3-yl)methoxy]-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

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