About: alpha-Ylangene

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About: alpha-Ylangene 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	химическое соединение (ru) chemical compound (en) composé chimique (fr) compositum chemicum (la) chemische Verbindung (de) քիմիական միացություն (hy) chemische verbinding (nl) compuestu químicu (ast) хімічна сполука (uk) রাসায়নিক যৌগ (bn)
rdfs:label	alpha-Ylangene (en)
skos:prefLabel	alpha-Ylangene (en)
name	alpha-Ylangene (en)
isomeric SMILES	wds:Q105288807-3D49FAC7-6791-424C-BD97-E68AF83D4840
stereoisomer of	wds:Q105288807-0DE140AA-99D8-45CF-830E-7B0BF95D85F4 wds:Q105288807-40523C0D-B2CD-438B-8167-F95936296B1B wds:Q105288807-B1BC879B-2C23-425F-A424-2A74B7E5E7B1 wds:Q105288807-C3C0457C-F96F-42C6-B1F8-348E42A1DA8D wds:Q105288807-E4353E5F-6FD1-482E-98AE-E12DE3713007
isomeric SMILES	CC1=CC[C@@H]2[C@H]3[C@H](C(C)C)CC[C@]2(C)[C@@H]13
stereoisomer of	alpha-copaene (1R,2S,6S,7S,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene UNII-78123715A8 (1R,2R,6R,7S,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene alpha-ylangene
instance of	wds:Q105288807-79262B73-3705-46CC-9EB1-887C8E1BBD27
instance of	type of chemical entity
subclass of	wds:Q105288807-55B1E8AC-3229-4090-974B-C98A02B30874 wds:Q105288807-7D9C357A-46AA-4B6D-9E8E-911E0DD71336 wds:Q105288807-A938CCF4-BFB6-4C34-A9AA-51A741FBC430 wds:Q105288807-CB0930DE-ADDB-4742-9186-37561DCBB8C1 wds:Q105288807-DA73F7C7-E914-4CF2-A9B3-0CAB5B319DF0 wds:Q105288807-E7604179-D6BA-41CA-A2F8-210B3E51C134 wds:Q105288807-F66F3016-811F-485C-B2D9-0E82DBA3E051
subclass of	α-copaene (1R,2S,7S,8S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene (1S,6R,8S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene 1,3-Dimethyl-8-(1-methylethyl)-tricyclo[4.4.0.02,7]dec-3-ene (1S,2R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene (2R,6R,8R)-8-isopropyl-1,3-dimethyltricyclo[4.4.0.0²,⁷]dec-3-ene (1S,2R,6R,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
found in taxon	wds:Q105288807-014BB998-F027-49BA-9AE7-AEC9EBBD0849 wds:Q105288807-0255C69D-2749-42E4-85F4-F4376CDA4B3A wds:Q105288807-727435C1-03CB-40E6-B544-85F6E10F42F1 wds:Q105288807-7DF802E9-BCA6-4A07-A8C8-EEDED120AC7A wds:Q105288807-7F0FE559-E963-460E-8CF9-480646F5B64B wds:Q105288807-81E9610E-EBEB-4EAF-A092-AF450E50AD30 wds:Q105288807-99323103-762C-4031-9C7B-EA549F7B1866 wds:Q105288807-9AB81B75-C1F0-435F-9A11-62994057BABE wds:Q105288807-9B7A4784-243B-46DF-BA79-4C6B7C062688 wds:Q105288807-CD7831B5-9767-44DB-8B1F-062F78E8FDFA wds:Q105288807-D6CCCAA3-5DE4-473A-A197-077963990C8E wds:Q105288807-E2B167F6-F965-4DCF-9533-CE7FEF8D1162 wds:Q105288807-EA8B4760-91E2-4129-A972-859401605703 wds:Q105288807-EF6699EE-B169-436C-B6A1-E88538E1FBE7 wds:Q105288807-F01DDC36-9730-41FC-816A-8D4F96BF004F wds:Q105288807-F52ACAF1-E0C4-4267-BEDA-52668F13A321 wds:Q105288807-FD86359C-6F51-46A2-8307-E231D5CDF579
found in taxon	Humulus lupulus Cedrus libani celery Kumquat Valeriana officinalis Arabidopsis thaliana Mangifera indica Capsicum annuum Piper nigrum Ganoderma lucidum Perilla frutescens Trifoliate orange Canella Cistus creticus Lepidozia fauriana Marsupella emarginata Lepidozia vitrea
UniChem compound ID	wds:Q105288807-1BC00D0C-647B-43DD-A9AE-641A8220081E
CAS Registry Number	wds:Q105288807-E399122C-AAE0-41A6-9B19-C5C29078674B
canonical SMILES	wds:Q105288807-6CFE44DE-9204-4C0C-9035-EA348F6B4E36
InChI	wds:Q105288807-420F1AE1-40B2-4866-A44D-53B38C21A5A4
InChIKey	wds:Q105288807-697AB178-E69D-47FE-ADA6-21182DBC8065
chemical formula	wds:Q105288807-631920FE-194D-43D7-86FB-E197B6DB240B
PubChem CID	wds:Q105288807-BB6FBA3D-97FB-49E5-8A05-3FE6F94CF8CA
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID20055075
UniChem compound ID	63582660
CAS Registry Number	14912-44-8
canonical SMILES	C1=C(C)C2C3C(CCC2(C)C3C1)C(C)C
InChI	InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h5,9,11-14H,6-8H2,1-4H3/t11-,12+,13+,14-,15-/m0/s1
InChIKey	VLXDPFLIRFYIME-QRTUWBSPSA-N
chemical formula	C₁₅H₂₄
PubChem CID	20055075
Cannabis Database ID	wds:Q105288807-54F32E24-3BA7-4055-96B1-40B39DC066EE
Cannabis Database ID	000468
mass	wds:Q105288807-4C634B46-FB18-466A-B02D-2C1EF1CD8E04
mass	204.187800768 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105288807
is stereoisomer of of	alpha-copaene (1R,2S,6S,7S,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene UNII-78123715A8 (1R,2R,6R,7S,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene

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