About: (1R,3S,4R,6S,7R,9R)-4-bromo-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decan-6-ol

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About: (1R,3S,4R,6S,7R,9R)-4-bromo-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decan-6-ol 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,3S,4R,6S,7R,9R)-4-bromo-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decan-6-ol (en)
skos:prefLabel	(1R,3S,4R,6S,7R,9R)-4-bromo-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decan-6-ol (en)
name	(1R,3S,4R,6S,7R,9R)-4-bromo-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decan-6-ol (en)
isomeric SMILES	wds:Q105182896-90B0B45E-4134-4510-A191-025E844BBFC6
stereoisomer of	wds:Q105182896-B6A4CADE-19FD-4F19-AC6C-9BFEABC326E9 wds:Q105182896-B83C4821-8D0E-45EC-A684-9F391C521742 wds:Q105182896-D0F34378-C4B1-4A79-A479-3761F57A92AA wds:Q105182896-EA9A376C-F7E8-479F-99F7-1B23F1A0A4F5
isomeric SMILES	C#CC=CC[C@H]1O[C@@H]2C[C@H]1O[C@@H](CC)[C@H](Br)C[C@@H]2O
stereoisomer of	Laurefurenyne F (1S,3R,4S,6R,7S,9R)-4-bromo-3-ethyl-9-[(Z)-pent-2-en-4-ynyl]-2,8-dioxabicyclo[5.2.1]decan-6-ol (1R,3R,4S,6R,7R,9R)-4-Bromo-3-ethyl-9-(2-penten-4-yn-1-yl)-2,8-dioxabicyclo[5.2.1]decan-6-ol Laurefurenyne E
instance of	wds:Q105182896-1083AA88-2B3E-4DA3-89A8-C1F8AE810CB0
instance of	type of chemical entity
subclass of	wds:Q105182896-0360793B-CF12-42B9-ACB7-26A9D944FCFB wds:Q105182896-48952147-3095-4272-AE8E-98C20B1A36DD wds:Q105182896-95F1B6CE-BFD4-4645-98BD-469CC1890F0A wds:Q105182896-CD870487-B0BE-44AB-8992-05C4E0F9E42B
subclass of	Laurefucin (1R,3R,4S,6R,7R)-4-bromo-3-ethyl-9-[(Z)-pent-2-en-4-ynyl]-2,8-dioxabicyclo[5.2.1]decan-6-ol (1R,3R,4S,6R,7R)-4-bromo-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decan-6-ol 4-Bromo-3-ethyl-9-pent-2-en-4-ynyl-2,8-dioxabicyclo[5.2.1]decan-6-ol
found in taxon	wds:Q105182896-5FDE5B6D-3F10-485C-9E5D-525A3FDC88D2
found in taxon	Laurencia
canonical SMILES	wds:Q105182896-B2065004-D221-4A7D-861E-154D4BA02F3B
InChI	wds:Q105182896-AC00EFDA-8C3F-402C-BEBF-C22596FC7365
InChIKey	wds:Q105182896-0AA80244-6FEE-4734-B422-812EB4A8618B
chemical formula	wds:Q105182896-6C908A04-6E74-49F5-9786-03E128147A2D
PubChem CID	wds:Q105182896-BC9BCFC9-26FE-4757-B754-AF57032C85B7
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID163193893
canonical SMILES	BrC1CC(O)C2OC(CC=CC#C)C(OC1CC)C2
InChI	InChI=1S/C15H21BrO3/c1-3-5-6-7-13-15-9-14(19-13)11(17)8-10(16)12(4-2)18-15/h1,5-6,10-15,17H,4,7-9H2,2H3/t10-,11+,12+,13-,14-,15-/m1/s1
InChIKey	NOYIFPKKLJWDFK-YXJLRHLOSA-N
chemical formula	C₁₅H₂₁BrO₃
PubChem CID	163193893
mass	wds:Q105182896-561F54BA-8BE3-466B-9744-5EC5BD31D587
mass	328.067406632 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105182896
is stereoisomer of of	Laurefurenyne F (1S,3R,4S,6R,7S,9R)-4-bromo-3-ethyl-9-[(Z)-pent-2-en-4-ynyl]-2,8-dioxabicyclo[5.2.1]decan-6-ol (1R,3R,4S,6R,7R,9R)-4-Bromo-3-ethyl-9-(2-penten-4-yn-1-yl)-2,8-dioxabicyclo[5.2.1]decan-6-ol Laurefurenyne E
is stereoisomer of of	wds:Q105182894-5142D16D-4BC0-4E7C-B8CB-85D6E68CAFB5 wds:Q105182888-0D637615-CB39-4743-BE61-9259AF580698 wds:Q105182892-48ACDECE-6D96-4092-A260-E0DEC3089259 wds:Q110189940-475BA5C6-642A-4619-AFBD-810F05A99C29
is main subject of	Laurefurenynes A–F, new Cyclic Ether Acetogenins from a Marine Red Alga, Laurencia sp.
is main subject of	wds:Q105182887-000BE078-DC8B-4145-AC44-8A9D4F6F2F7C

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