(Q105230353)

English

5,6,7-trihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

chemical compound

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instance of

type of chemical entity

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subclass of

5,6,7-Trihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one

1 reference

based on heuristic

inferred from SMILES

mass

610.15338488 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

5,6,7-trihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

5,6,7,4'-tetrahydroxyflavonol-3-O-rutinoside

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₀O₁₆

0 references

canonical SMILES

O=C1C(OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2O)=C(OC4=CC(O)=C(O)C(O)=C14)C=5C=CC(O)=CC5

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isomeric SMILES

C[C@H]1O[C@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)c(O)c(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O

0 references

found in taxon

Marrubium velutinum

1 reference

stated in

Identification of tyrosinase inhibitors from Marrubium velutinum and Marrubium cylleneum

Identifiers

InChI

InChI=1S/C27H30O16/c1-8-15(30)20(35)22(37)26(40-8)39-7-13-17(32)21(36)23(38)27(42-13)43-25-19(34)14-12(6-11(29)16(31)18(14)33)41-24(25)9-2-4-10(28)5-3-9/h2-6,8,13,15,17,20-23,26-33,35-38H,7H2,1H3/t8-,13-,15-,17-,20+,21+,22+,23-,26+,27+/m1/s1

0 references

InChIKey

QYRJNVCANQPMCH-BRRCEIDXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QYRJNVCANQPMCH-BRRCEIDXSA-N

1 reference

(Q105230353)

5,6,7-trihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

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