About: Rosmarinic Acid Methyl Ester

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About: Rosmarinic Acid Methyl Ester Goto Sponge NotDistinct Permalink

An Entity of Type : wikibase:Item, within Data Space : wikidata.demo.openlinksw.com associated with source document(s)

chemical compound

Attributes	Values
rdf:type	Item
description	composto chimico (it) химическое соединение (ru) chemical compound (en) composé chimique (fr) תרכובת (he) kemisk forbindelse (da) compositum chemicum (la) chemische Verbindung (de) քիմիական միացություն (hy) chemická sloučenina (cs) chemická zlúčenina (sk) chemische verbinding (nl) kemia kombinaĵo (eo) związek chemiczny (pl) chemical compound (en-ca) chemical compound (en-gb) chemiese verbinding (af) chemische Verbindung (de-ch) component quimic (oc) compost químic (ca) composto químico (gl) composto químico (pt) composto químico (pt-br) compuesto quimico (an) compuestu químicu (ast) compus chimic (ro) kemiallinen yhdiste (fi) kjemisk forbindelse (nb) kjemisk sambinding (nn) komponim kimik (sq) konposatu kimiko (eu) senyawa kimia (id) ķīmisks savienojums (lv) хімічна сполука (uk) مركب كيميائي (ar) রাসায়নিক যৌগ (bn) compuesto químico (es) payvastagii khimiyaviy (tg-latn) пайвастагии химиявӣ (tg-cyrl) chemesch Verbindung (lb)
rdfs:label	Rosmarinic Acid Methyl Ester (en)
skos:prefLabel	Rosmarinic Acid Methyl Ester (en)
name	Rosmarinic Acid Methyl Ester (en)
isomeric SMILES	wds:Q104400061-5B607B16-DEA3-4FBA-A6E0-20A7F5A52763
stereoisomer of	wds:Q104400061-28020D56-D8B9-4100-B4B8-69CD8E6352CC wds:Q104400061-5AEE71F0-D642-496E-92F0-D5FE0CDFA08F
isomeric SMILES	COC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)C=Cc1ccc(O)c(O)c1
stereoisomer of	(2R)-3-(3,4-dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate (S)-3-(3,4-Dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (E)-3-(3,4-dihydroxyphenyl)acrylate
instance of	wds:Q104400061-0450C666-08CD-4B6E-9A54-295D5E086817
instance of	type of chemical entity
subclass of	wds:Q104400061-25234F13-1EFF-42CA-8E5B-CBD870CC49A8 wds:Q104400061-F07D3542-E7AE-4534-B75D-ABF43FE0339A
subclass of	Methyl 3-(3,4-dihydroxyphenyl)-2-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoate 3-(3,4-dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
found in taxon	wds:Q104400061-13091E69-80CC-4ECE-8F47-D9ED45829DC5 wds:Q104400061-2F087820-7B13-437F-AF78-77E5B2263F77 wds:Q104400061-309D5565-6EF2-4F02-BEAD-229C4513567F wds:Q104400061-4220DE21-6B8C-4D2A-A2E6-EDD1E6F397D5 wds:Q104400061-5611C224-C2A0-4253-BCEF-7254E6FA4F9A wds:Q104400061-65D98169-532C-4303-B3BF-8EDC232B470F wds:Q104400061-72B4EED2-8E1A-43DF-91B3-54099887D275 wds:Q104400061-7CE19D27-8FF8-4E9C-84DF-FB217B8CF04F wds:Q104400061-7FB61C7E-CC3F-4A48-82A1-7E15A0E7D9DE wds:Q104400061-827F8C84-E753-4B03-A494-8B232C81C020 wds:Q104400061-8CB2F94E-6A7B-45DC-9520-BF20A8C917BB wds:Q104400061-8ECB7C6F-7FFA-44CB-8FB2-ADCC881C7B0D wds:Q104400061-E091ACF9-3148-4671-A021-42C6420FBB01
found in taxon	Salvia miltiorrhiza Prunella vulgaris Salvia trijuga Melissa officinalis Perilla frutescens Isodon oresbius Clinopodium laxiflorum Isodon coetsa Perilla frutescens var. frutescens Ehretia philippinensis Isodon inflexus Isodon longitubus Coleus parvifolius
UniChem compound ID	wds:Q104400061-7CFF76F9-BD5F-4C6B-8328-74647664990A
canonical SMILES	wds:Q104400061-DFBFF096-89CC-40A1-91ED-AC834E19EC3F
InChI	wds:Q104400061-5A774377-05DF-4735-907C-FB938527A875
InChIKey	wds:Q104400061-C9FBE758-3506-4885-B879-96E754D6DD6E
chemical formula	wds:Q104400061-7AE337BC-A680-4A1E-A6AF-C12515AAB48B
PubChem CID	wds:Q104400061-C6A248E1-5BF5-4C4C-9354-3610936BF415
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID3012090
UniChem compound ID	1080710
canonical SMILES	O=C(OC(C(=O)OC)CC1=CC=C(O)C(O)=C1)C=CC2=CC=C(O)C(O)=C2
InChI	InChI=1S/C19H18O8/c1-26-19(25)17(10-12-3-6-14(21)16(23)9-12)27-18(24)7-4-11-2-5-13(20)15(22)8-11/h2-9,17,20-23H,10H2,1H3/t17-/m1/s1
InChIKey	XHALVRQBZGZHFE-QGZVFWFLSA-N
chemical formula	C₁₉H₁₈O₈
PubChem CID	3012090
mass	wds:Q104400061-3DA336AA-93CF-4E79-8C82-7B6D6AAD129C
mass	374.100167536 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q104400061
is stereoisomer of of	(2R)-3-(3,4-dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate (S)-3-(3,4-Dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (E)-3-(3,4-dihydroxyphenyl)acrylate

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