(Q115949593)

English

(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoxy]oxane-3,4,5-triol

chemical compound

In more languages

Statements

type of chemical entity

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chemical compound

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386.157682412 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₂₆O₉

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canonical SMILES

OCC1OC(OCC=CC2=CC=C(OC)C(OC)=C2OC)C(O)C(O)C1O

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isomeric SMILES

COc1ccc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(OC)c1OC

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Phlomoides rotata

1 reference

Constituent analysis and quality control of Lamiophlomis rotata by LC-TOF/MS and HPLC-UV.

Identifiers

InChI=1S/C18H26O9/c1-23-11-7-6-10(16(24-2)17(11)25-3)5-4-8-26-18-15(22)14(21)13(20)12(9-19)27-18/h4-7,12-15,18-22H,8-9H2,1-3H3/b5-4+/t12-,13-,14+,15-,18-/m1/s1

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QLFKXHHDGADCAX-VKLSVLLSSA-N

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1 reference

2 January 2023

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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