(Q105266808)

English

1,3,6,7-tetrahydroxy-2-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one

chemical compound

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instance of

type of chemical entity

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subclass of

1,3,6,7-tetrahydroxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}xanthen-9-one

1 reference

based on heuristic

inferred from SMILES

mass

438.079826016 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

1,3,6,7-tetrahydroxy-2-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

1,3,6,7-tetrahydroxy-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₉H₁₈O₁₂

0 references

canonical SMILES

O=C1C2=CC(O)=C(O)C=C2OC3=CC(O)=C(OC4OC(CO)C(O)C(O)C4O)C(O)=C13

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isomeric SMILES

O=c1c2cc(O)c(O)cc2oc2cc(O)c(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12

0 references

found in taxon

Swertia chirata

1 reference

stated in

Studies on the Constituents of Swertia japonica. V. : On the Xanthone Constituents of the Plants of Swertia spp

Swertia chirayita

1 reference

stated in

Studies on the Constituents of Swertia japonica. V. : On the Xanthone Constituents of the Plants of Swertia spp

Swertia chirayta

1 reference

stated in

Studies on the Constituents of Swertia japonica. V. : On the Xanthone Constituents of the Plants of Swertia spp

Identifiers

InChI

InChI=1S/C19H18O12/c20-4-11-14(25)16(27)17(28)19(30-11)31-18-8(23)3-10-12(15(18)26)13(24)5-1-6(21)7(22)2-9(5)29-10/h1-3,11,14,16-17,19-23,25-28H,4H2/t11-,14+,16-,17+,19-/m0/s1

0 references

InChIKey

TXKFRRCKZWJXBW-ZDNICESLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

TXKFRRCKZWJXBW-ZDNICESLSA-N

(Q105266808)

1,3,6,7-tetrahydroxy-2-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one

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