About: [(1R,2R,6R,7S,8aR)-6-hydroxy-1,8a-dimethyl-7-prop-1-en-2-yl-2,3,4,6,7,8-hexahydro-1H-naphthalen-2-yl] (E)-3-[(R)-methylsulfinyl]prop-2-enoate

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About: [(1R,2R,6R,7S,8aR)-6-hydroxy-1,8a-dimethyl-7-prop-1-en-2-yl-2,3,4,6,7,8-hexahydro-1H-naphthalen-2-yl] (E)-3-[(R)-methylsulfinyl]prop-2-enoate 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	[(1R,2R,6R,7S,8aR)-6-hydroxy-1,8a-dimethyl-7-prop-1-en-2-yl-2,3,4,6,7,8-hexahydro-1H-naphthalen-2-yl] (E)-3-[(R)-methylsulfinyl]prop-2-enoate (en)
skos:prefLabel	[(1R,2R,6R,7S,8aR)-6-hydroxy-1,8a-dimethyl-7-prop-1-en-2-yl-2,3,4,6,7,8-hexahydro-1H-naphthalen-2-yl] (E)-3-[(R)-methylsulfinyl]prop-2-enoate (en)
name	[(1R,2R,6R,7S,8aR)-6-hydroxy-1,8a-dimethyl-7-prop-1-en-2-yl-2,3,4,6,7,8-hexahydro-1H-naphthalen-2-yl] (E)-3-[(R)-methylsulfinyl]prop-2-enoate (en)
isomeric SMILES	wds:Q105200789-B6C7803F-E536-4615-8D50-C82ADEC9CF73
isomeric SMILES	C=C(C)[C@@H]1C[C@@]2(C)C(=C[C@H]1O)CC[C@@H](OC(=O)/C=C/[S@@+](C)[O-])[C@@H]2C
instance of	wds:Q105200789-D378E0DB-6725-409F-A399-6495AABF9FA6
instance of	type of chemical entity
subclass of	wds:Q105200789-0280014A-8A70-4825-B62D-9BBEE4189CB5
subclass of	Petasinol
found in taxon	wds:Q105200789-27ED0E41-7D1D-416E-A612-8D4B7D11B45F
found in taxon	Petasites formosanus
canonical SMILES	wds:Q105200789-4D731700-DAA3-415B-AC27-1803F19F6B59
InChI	wds:Q105200789-E8E299E1-CF2D-488C-B053-7479C7C9C8EC
InChIKey	wds:Q105200789-0C1B4564-C782-4EF6-90B9-6142C34C4674
chemical formula	wds:Q105200789-EFD3C901-1D73-4479-9FC2-82E6DA7151FC
PubChem CID	wds:Q105200789-3A0B70B2-6FFA-4BDF-AE64-85F9CBBE52FB
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID163000959
canonical SMILES	O=C(OC1CCC2=CC(O)C(C(=C)C)CC2(C)C1C)C=C[S+]([O-])C
InChI	InChI=1S/C19H28O4S/c1-12(2)15-11-19(4)13(3)17(7-6-14(19)10-16(15)20)23-18(21)8-9-24(5)22/h8-10,13,15-17,20H,1,6-7,11H2,2-5H3/b9-8+/t13-,15-,16+,17+,19+,24+/m0/s1
InChIKey	OVLGYAHWOSBKJJ-XAPHTKGSSA-N
chemical formula	C₁₉H₂₈O₄S
PubChem CID	163000959
mass	wds:Q105200789-8F518127-6F36-44B4-86F6-FABE9220762E
mass	352.170830376 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105200789
is main subject of	Four new sesquiterpenes from Petasites formosanus
is main subject of	wds:Q74806410-8DAC846F-FAAF-4243-B499-29B4502B2321

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