(Q110177920)

English

10-hydroxy-5,7-dimethoxy-3-methyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxybenzo[g]isochromen-1-one

chemical compound

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instance of

type of chemical entity

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subclass of

10-Hydroxy-5,7-dimethoxy-3-methyl-9-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxybenzo[g]isochromen-1-one

1 reference

based on heuristic

inferred from SMILES

mass

626.184685008 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

1-Oxo-3-methyl-5,7-dimethoxy-10-hydroxy-1H-naphtho[2,3-c]pyran-9-yl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

10-hydroxy-5,7-dimethoxy-3-methyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxybenzo[g]isochromen-1-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₃₄O₁₆

0 references

canonical SMILES

O=C1OC(=CC=2C(OC)=C3C=C(OC)C=C(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)C3=C(O)C12)C

0 references

isomeric SMILES

COc1cc(O[C@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c2c(O)c3c(=O)oc(C)cc3c(OC)c2c1

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found in taxon

Paepalanthus geniculatus

1 reference

stated in

HPLC-ESIMS(n) profiling, isolation, structural elucidation, and evaluation of the antioxidant potential of phenolics from Paepalanthus geniculatus

Identifiers

InChI

InChI=1S/C28H34O16/c1-9-4-11-17(26(37)41-9)20(32)16-12(25(11)39-3)5-10(38-2)6-13(16)42-28-24(36)22(34)19(31)15(44-28)8-40-27-23(35)21(33)18(30)14(7-29)43-27/h4-6,14-15,18-19,21-24,27-36H,7-8H2,1-3H3/t14-,15-,18-,19-,21+,22+,23-,24-,27+,28+/m1/s1

0 references

InChIKey

KYVFVYNZFJMBPD-DOQBZNPLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KYVFVYNZFJMBPD-DOQBZNPLSA-N

1 reference

(Q110177920)

10-hydroxy-5,7-dimethoxy-3-methyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxybenzo[g]isochromen-1-one

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