(Q110190510)

English

1,3,5,8-Tetrahydroxy-2-(1,4,6,8-tetrahydroxy-9-oxoxanthen-2-yl)-7-[1,3,5-trihydroxy-9-oxo-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6,7,8-tetrahydroxanthen-2-yl]xanthen-9-one

group of stereoisomers with the chemical formula C₄₅H₃₄O₂₃

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

942.149087348 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₅H₃₄O₂₃

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canonical SMILES

O=C1C=2C(O)=CC(O)=CC2OC3=C(O)C=C(C(O)=C13)C4=C(O)C=C5OC6=C(O)C=C(C(O)=C6C(=O)C5=C4O)C7=C(O)C=C8OC9=C(C(=O)C8=C7O)C(OC%10OC(CO)C(O)C(O)C%10O)CCC9O

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found in taxon

Swertia punicea

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stated in

Neuroprotective Xanthone Glycosides from Swertia punicea

Identifiers

InChI

InChI=1S/C45H34O23/c46-9-23-34(56)40(62)41(63)45(68-23)67-19-2-1-13(48)42-29(19)38(60)27-21(65-42)7-15(50)24(35(27)57)12-6-18(53)44-31(33(12)55)39(61)28-22(66-44)8-16(51)25(36(28)58)11-5-17(52)43-30(32(11)54)37(59)26-14(49)3-10(47)4-20(26)64-43/h3-8,13,19,23,34,40-41,45-58,62-63H,1-2,9H2

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InChIKey

HPKJZJOAGMXGIP-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HPKJZJOAGMXGIP-UHFFFAOYSA-N

(Q110190510)

1,3,5,8-Tetrahydroxy-2-(1,4,6,8-tetrahydroxy-9-oxoxanthen-2-yl)-7-[1,3,5-trihydroxy-9-oxo-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6,7,8-tetrahydroxanthen-2-yl]xanthen-9-one

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Identifiers

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