About: 3-Epitaraxeryl acetate

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About: 3-Epitaraxeryl acetate 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	3-Epitaraxeryl acetate (en)
skos:prefLabel	3-Epitaraxeryl acetate (en)
name	3-Epitaraxeryl acetate (en)
isomeric SMILES	wds:Q105366761-545E8511-0F4F-4EAD-9B22-F65F07DA0EF2
stereoisomer of	wds:Q105366761-2273E099-3073-4B8A-86E1-4DB5B61DA4C3 wds:Q105366761-284F149B-C1A0-4DBD-ABBB-D5922D507856 wds:Q105366761-29D871E0-3915-4457-B240-E8B732B05103 wds:Q105366761-6C5CE419-7F19-47A3-9C1E-D79B0599D783 wds:Q105366761-B328EFF6-933E-44D5-B3B5-D108255A2760 wds:Q105366761-EC50093E-7964-41FF-B13C-13F01882C2FE
isomeric SMILES	CC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)C4=CC[C@@]5(C)CCC(C)(C)C[C@H]5[C@]4(C)CC[C@@H]32)C1(C)C
stereoisomer of	Acetyl taraxerol [(3S,4aS,6aR,6aR,8aR,12aS,14aS,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate [(3S,4aS,6aR,6aS,8aR,12aS,14aR,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate [(3R,4aR,6aS,6aS,8aS,12aR,14aS,14bS)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate [(3S,4aR,6aR,6aS,8aR,12aR,14aS,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate [(3S,4aR,6aR,6aR,8aR,12aR,14aR,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate
instance of	wds:Q105366761-2341F8EF-4081-4FA5-8C50-5D8560E2A2DE
instance of	type of chemical entity
subclass of	wds:Q105366761-3C0F2C37-B93B-4E55-8D9C-915AB6B9CBD7 wds:Q105366761-7C621997-82FD-47C7-8237-626F19D0EA3C wds:Q105366761-E228E691-D949-4B5F-839A-FBFEC359C3C0 wds:Q105366761-F239EE37-F806-429D-95A6-FBF757A32420
subclass of	(4,4,6a,6a,8a,11,11,14b-Octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl) acetate [(3S,4aR,6aR,8aR,12aR,14aR,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate (3S,6aR,8aR,12aR,14bR)-4,4,6a,8a,11,11,12b,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl acetate [(4aS,6aR,6aS,8aR,12aR,14aR,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate
found in taxon	wds:Q105366761-111EEEF2-36F2-4815-B382-467F8B276A1B wds:Q105366761-16817A92-59EE-4156-AC06-3770CA290982 wds:Q105366761-52A2288E-2F0D-466B-B2C8-AAAC535F8320 wds:Q105366761-55E048C0-3BE1-465F-93F7-CF6F6B8A96AC wds:Q105366761-DDBF4C37-0B87-4943-AEC3-42D449B08764
found in taxon	Melaleuca leucadendra Sedum sexangulare Sedum forsterianum Oreoseris gossypina Petrosedum forsterianum
UniChem compound ID	wds:Q105366761-CFBA3F9F-8DBB-4346-816A-32D3D5247BA4
canonical SMILES	wds:Q105366761-8EE9AC5F-1A90-4D0D-9759-A9AE7289F155
InChI	wds:Q105366761-DBB0FA16-BCDC-4652-B719-2421CBC4BA21
InChIKey	wds:Q105366761-75F674FA-1B17-48B0-AD51-531A0C177E86
chemical formula	wds:Q105366761-6FEF9AD8-75AC-4E80-BC8B-C8E29C2A3D46
PubChem CID	wds:Q105366761-7B11B435-0284-4FC9-853F-7EA09DD089CF
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID101334468
UniChem compound ID	96658054
canonical SMILES	O=C(OC1CCC2(C)C3CCC4(C(=CCC5(C)CCC(C)(C)CC45)C3(C)CCC2C1(C)C)C)C
InChI	InChI=1S/C32H52O2/c1-21(33)34-26-13-17-30(7)22(28(26,4)5)11-15-31(8)23-10-14-29(6)19-18-27(2,3)20-25(29)32(23,9)16-12-24(30)31/h10,22,24-26H,11-20H2,1-9H3/t22-,24+,25+,26+,29-,30-,31-,32+/m0/s1
InChIKey	YWJGYBXHXATAQY-QORNOPJGSA-N
chemical formula	C₃₂H₅₂O₂
PubChem CID	101334468
mass	wds:Q105366761-2317C0A8-8563-45EB-A1A2-5598F4104E4E
mass	468.396730904 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105366761
is stereoisomer of of	Acetyl taraxerol [(3S,4aS,6aR,6aR,8aR,12aS,14aS,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate [(3S,4aS,6aR,6aS,8aR,12aS,14aR,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate [(3R,4aR,6aS,6aS,8aS,12aR,14aS,14bS)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate [(3S,4aR,6aR,6aS,8aR,12aR,14aS,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate [(3S,4aR,6aR,6aR,8aR,12aR,14aR,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] acetate

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