(Q105251638)

English

(2R)-2-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-1,4-benzoxazin-3-one

group of stereoisomers with the chemical formula C₁₄H₁₇NO₇

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Statements

instance of

group of stereoisomers

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1 reference

311.100501884 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₄H₁₇NO₇

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canonical SMILES

O=C1Nc2ccccc2OC1C1OC(CO)C(O)C(O)C1O

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isomeric SMILES

O=C1Nc2ccccc2O[C@@H]1C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Ruellia tuberosa

1 reference

stated in

Chemical constituents from the leaves of Ruellia tuberosa

Identifiers

InChI

InChI=1S/C14H17NO7/c16-5-8-9(17)10(18)11(19)12(22-8)13-14(20)15-6-3-1-2-4-7(6)21-13/h1-4,8-13,16-19H,5H2,(H,15,20)/t8-,9-,10+,11-,12?,13-/m1/s1

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InChIKey

SFAHCAMKUIRNCU-DMEHNAEFSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SFAHCAMKUIRNCU-DMEHNAEFSA-N

(Q105251638)

(2R)-2-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-1,4-benzoxazin-3-one

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Identifiers

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