(Q104915427)

English

(E)-3-[4-hydroxy-3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexa-1,5-dien-1-yl]prop-2-enoic acid

group of stereoisomers with the chemical formula C₁₆H₂₂O₁₀

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Statements

group of stereoisomers

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chemical compound

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374.121296904 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₆H₂₂O₁₀

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canonical SMILES

O=C(O)C=CC=1C=CC(O)(OC2OC(CO)C(O)C(O)C2O)C(OC)C1

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isomeric SMILES

COC1C=C(/C=C/C(=O)O)C=CC1(O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

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Aristolochia kaempferi

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Constituents from the stem and root of Aristolochia kaempferi

Identifiers

InChI=1S/C16H22O10/c1-24-10-6-8(2-3-11(18)19)4-5-16(10,23)26-15-14(22)13(21)12(20)9(7-17)25-15/h2-6,9-10,12-15,17,20-23H,7H2,1H3,(H,18,19)/b3-2+/t9-,10?,12-,13+,14-,15+,16?/m1/s1

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ANUYXRVPTZDOBN-SSGQYCISSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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