(Q105177469)

English

6-[2-[[(2R,4aR,6S,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-4-hydroxy-6-methylphenyl]-4-methoxypyran-2-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

6-[2-[(7,8-Dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-4-hydroxy-6-methylphenyl]-4-methoxypyran-2-one

1 reference

based on heuristic

inferred from SMILES

mass

436.136946968 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₄O₁₀

0 references

canonical SMILES

O=C1OC(=CC(OC)=C1)C=2C(OC3OC4COC(OC4C(O)C3O)C)=CC(O)=CC2C

0 references

isomeric SMILES

COc1cc(-c2c(C)cc(O)cc2O[C@@H]2O[C@@H]3CO[C@@H](C)O[C@H]3[C@H](O)[C@H]2O)oc(=O)c1

0 references

found in taxon

Aloe castellorum

1 reference

stated in

New bioactive compounds from Aloe hijazensis

Identifiers

InChI

InChI=1S/C21H24O10/c1-9-4-11(22)5-13(17(9)14-6-12(26-3)7-16(23)29-14)30-21-19(25)18(24)20-15(31-21)8-27-10(2)28-20/h4-7,10,15,18-22,24-25H,8H2,1-3H3/t10-,15-,18-,19-,20-,21-/m1/s1

0 references

InChIKey

NDBMPRJQWMEOOY-BZBPHNQHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NDBMPRJQWMEOOY-BZBPHNQHSA-N

(Q105177469)

6-[2-[[(2R,4aR,6S,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-4-hydroxy-6-methylphenyl]-4-methoxypyran-2-one

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