About: methyl (4S,5E,6R)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate

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About: methyl (4S,5E,6R)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate Goto Sponge NotDistinct Permalink

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chemical compound

Attributes	Values
rdf:type	Item
description	химическое соединение (ru) chemical compound (en) composé chimique (fr) compositum chemicum (la) chemische Verbindung (de) chemische verbinding (nl) compuestu químicu (ast) хімічна сполука (uk) রাসায়নিক যৌগ (bn)
rdfs:label	methyl (4S,5E,6R)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate (en)
skos:prefLabel	methyl (4S,5E,6R)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate (en)
name	methyl (4S,5E,6R)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate (en)
isomeric SMILES	wds:Q104391252-28F726F2-F125-4A88-ACDE-923EA39E785A
stereoisomer of	wds:Q104391252-03F1A5DC-DCB5-48FD-B97B-F4D5068EAA84 wds:Q104391252-20F69E9D-AB68-47DB-994B-6B8F6232EA11 wds:Q104391252-493887B9-CCD0-416A-A01C-EA5D84DD9FB1 wds:Q104391252-69EADD32-4FEA-4D2D-A939-2CD7D958AED7 wds:Q104391252-753CA457-152E-4F98-83C3-1ACC57D5D3B8 wds:Q104391252-D893241A-9188-4709-BCC4-73EDB14E7C28 wds:Q104391252-F3587101-1F3D-46E2-8F42-2092862038E5
isomeric SMILES	C/C=C1\[C@H](CC(=O)OCCc2ccc(O)cc2)C(C(=O)OC)=CO[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
stereoisomer of	ligstroside methyl (4S,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl (4S,5E,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl (4S,5Z,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl (4R,5E,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl (4S,5E,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate Ligustroside
instance of	wds:Q104391252-808AC2CE-0444-4DCC-A9EF-E255E786BD3D
instance of	type of chemical entity
subclass of	wds:Q104391252-5136514D-27A6-4A27-8E29-BEFC7E49B0CD wds:Q104391252-B07AD1DB-5A85-483C-86F3-194976E5E871 wds:Q104391252-DCEE09A4-230D-4857-AD0F-7356011F3067
subclass of	methyl (5Z)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl 5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl (5Z)-5-ethylidene-4-{2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl}-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
found in taxon	wds:Q104391252-0881E499-50C7-47D3-95DF-0BE2BBBBF399 wds:Q104391252-196C153E-F75D-4C3C-B4F7-B45442740DC6 wds:Q104391252-2902AD3E-6EBD-4F33-AC09-D56614ACFC98 wds:Q104391252-2CAB3E66-FF7D-4136-8001-A6E651289002 wds:Q104391252-379D0C5E-B4EC-42E8-B403-A4EB309B0901 wds:Q104391252-3C8CC877-0961-4560-A4E4-084F10E3900C wds:Q104391252-4FE2B23F-205A-4C56-95BD-FB7D96B424A4 wds:Q104391252-5DC8545D-6E03-4106-BFB8-C88795BF85E6 wds:Q104391252-7DF4EFAE-9BA7-4A35-A818-14E71F8821CD wds:Q104391252-B255EF90-7760-4CA5-A1D8-EF5BE22473D8 wds:Q104391252-BC09A950-25CB-42C3-9535-F2B26354D155 wds:Q104391252-DF67A8A6-4B87-430C-A907-B89BFD43E0D4 wds:Q104391252-F62B716F-66F4-4E20-8E5C-10CA8D47C2D8 wds:Q104391252-FE77ADB7-E192-4068-93C8-32E5C7BB95A0
found in taxon	Phillyrea latifolia Fraxinus Fraxinus ornus Ligustrum obtusifolium Osmanthus fragrans Brucea javanica Ligustrum vulgare Osmanthus heterophyllus Ligustrum lucidum Syringa vulgaris Jasminum polyanthum Fraxinus uhdei Osmanthus × fortunei Osmanthus ilicifolius
UniChem compound ID	wds:Q104391252-6CB10180-E814-4657-B248-1A07412A6534
canonical SMILES	wds:Q104391252-DE590AC7-7436-4074-8BC5-F4F8D1853C93
InChI	wds:Q104391252-84818D95-4341-481A-BD69-2E93C9913278
InChIKey	wds:Q104391252-0FA278D5-0E27-4B14-B803-961F3147E498
chemical formula	wds:Q104391252-2B5D11DA-6564-4C1C-9DDF-A1B0FA59BB9A
PubChem CID	wds:Q104391252-46CF6473-034E-429B-A373-28F65B475F2E
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID75492723
UniChem compound ID	80417129
canonical SMILES	O=C(OC)C1=COC(OC2OC(CO)C(O)C(O)C2O)C(=CC)C1CC(=O)OCCC3=CC=C(O)C=C3
InChI	InChI=1S/C25H32O12/c1-3-15-16(10-19(28)34-9-8-13-4-6-14(27)7-5-13)17(23(32)33-2)12-35-24(15)37-25-22(31)21(30)20(29)18(11-26)36-25/h3-7,12,16,18,20-22,24-27,29-31H,8-11H2,1-2H3/b15-3+/t16-,18+,20+,21-,22+,24+,25-/m0/s1
InChIKey	GMQXOLRKJQWPNB-OETWDZMNSA-N
chemical formula	C₂₅H₃₂O₁₂
PubChem CID	75492723
mass	wds:Q104391252-9AC9092B-9B85-478F-B0CC-A7A552CB76EC
mass	524.189376464 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q104391252
is stereoisomer of of	ligstroside methyl (4S,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl (4S,5E,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl (4S,5Z,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl (4R,5E,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate methyl (4S,5E,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate Ligustroside
is stereoisomer of of	wds:Q105012091-BFD14E06-951B-4CE9-8AF7-EB9B380D3ED7 wds:Q105012102-6919C351-E674-49AE-A448-A96CDE894B93 wds:Q105012092-F594392E-68C8-406F-9727-1F7393D42A82 wds:Q27269447-7B7FB49E-D248-4E9E-BA13-BF242546500A wds:Q76415581-B1B3F73B-DE2B-47BB-92CE-9614D7677109 wds:Q105012100-8C1646ED-7B81-413E-B307-6395C540F8C0 wds:Q105012098-6C09837A-D2A4-4B2B-9847-6C1E6C23FFA6
is main subject of	Studies on the Constituents of Ligustrum Species. IX. On the Components of the Fruits of Ligustrum obtusifolium SIEB. et ZUCC. (3) TLC and HPLC analysis of syringin in Syringa vulgaris Studies on the Constituents of Osmanthus Species. IV. On the Components of the Leaves of Osmanthus fortunei CARR. Studies on the Constituents of Osmanthus Species. III. On the Components of the Leaves of Osmanthus ilicifolius (HASSK.) MOUILLEFERT In vitro evaluation of secoiridoid glucosides from the fruits of Ligustrum lucidum as antiviral agents

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