About: [(4S,8R,9S,9bS)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] (2S)-3-chloro-2-hydroxy-2-methylpropanoate

Facets (new session)
Description
Metadata
Settings
- owl:sameAs
- Inference Rule:

About: [(4S,8R,9S,9bS)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] (2S)-3-chloro-2-hydroxy-2-methylpropanoate Goto Sponge NotDistinct Permalink

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

group of stereoisomers with the chemical formula C₁₉H₂₄Cl₂O₇

Attributes	Values
rdf:type	Item
description	groep van stereo-isomeren (nl) group of stereoisomers with the chemical formula C₁₉H₂₄Cl₂O₇ (en) група стереоізомерів з хімічною формулою C₁₉H₂₄Cl₂O₇ (uk)
rdfs:label	[(4S,8R,9S,9bS)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] (2S)-3-chloro-2-hydroxy-2-methylpropanoate (en)
skos:prefLabel	[(4S,8R,9S,9bS)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] (2S)-3-chloro-2-hydroxy-2-methylpropanoate (en)
name	[(4S,8R,9S,9bS)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] (2S)-3-chloro-2-hydroxy-2-methylpropanoate (en)
isomeric SMILES	wds:Q104252621-B45512B4-A9CD-4063-AC19-9DBCCCB0BB3E
isomeric SMILES	C=C1C[C@H](OC(=O)[C@](C)(O)CCl)C2C(=C)C(=O)O[C@@H]2C2C1C[C@@H](O)[C@]2(O)CCl
instance of	wds:Q104252621-D974FF18-6FD1-43D4-8746-05FD27036D01
instance of	group of stereoisomers
subclass of	wds:Q104252621-626CA22D-F2C9-431A-8BA0-905F0BE1B7BA
subclass of	guaiane sesquiterpenoid
found in taxon	wds:Q104252621-0A6648C2-863E-495A-9BA8-7F29498DFF42 wds:Q104252621-1848DE20-0EC1-4626-9241-BD5CE3568ABC wds:Q104252621-1DD8C251-56A1-44A2-A90A-3AE22B2F083F wds:Q104252621-32DD2A75-7820-46EF-BD2E-FF233D2515AE wds:Q104252621-402103CB-EBA0-4A26-B6B2-BCE0B53E4603 wds:Q104252621-43514952-41FE-47E0-8248-CF2F7979BBE3 wds:Q104252621-4F6FA362-D1D4-4FB5-A950-D2BE73C525F4 wds:Q104252621-556C9367-62EC-494C-A316-591BD9EF5C59 wds:Q104252621-617D9863-40A1-4BF6-9B64-BA834C8134C9 wds:Q104252621-8373914C-2BA1-4741-90B1-BDAD5D01FD31 wds:Q104252621-850B69EF-6BE9-4018-BE20-33168A00EFE6 wds:Q104252621-87F32DFD-7A09-4334-B77D-933D14804225 wds:Q104252621-970A2EC7-E037-4851-91F8-10182E95DE33 wds:Q104252621-9E970C73-630C-48A0-B687-75596C9E15F2 wds:Q104252621-A4712F1C-BF45-4DEC-BC7C-C09A892CE3EC wds:Q104252621-A71A3D55-84B4-4E92-8210-C7E7029F6664 wds:Q104252621-A8EAD565-B819-4AB2-A028-7667437E9069 wds:Q104252621-BADE7D19-FEE9-4BE5-9112-8E710DC50AAC wds:Q104252621-C3D666D8-315F-46BD-8ACA-120969E0B147 wds:Q104252621-C8B89361-1022-472D-851F-415476ABB086 wds:Q104252621-DC35AEAD-6DC6-44BE-838E-34214D5DC859 wds:Q104252621-E56031B7-289E-40C6-9FF7-420AD2C5956A wds:Q104252621-FA452781-0B9C-4525-8367-BB9BD119FDCA wds:Q104252621-FF9C1DEA-5E6F-48CD-B087-976E02B4B2E4
found in taxon	Rhaponticum repens Centaurea solstitialis Centaurea dealbata Centaurea sinaica Psephellus bellus Psephellus colchicus Acroptilon repens Centaurea gabrieljanae Psephellus dealbatus Psephellus nogmovii Rhaponticum coniferum Saussurea candicans Centaurea aegyptiaca Centaurea pterocaula Psephellus carthalinicus Psephellus adjaricus Psephellus simplicicaulis Psephellus somcheticus Psephellus daghestanicus Psephellus zangezuri Psephellus karabaghensis Chartolepis glastifolia Leuzea conifera Centaurea imperialis
UniChem compound ID	wds:Q104252621-B559EC62-3CAE-4F97-9E62-5320C569A012
canonical SMILES	wds:Q104252621-1BED1461-ED0B-4BCE-8A4F-F614E7E4AA0F
InChI	wds:Q104252621-5D60CAE7-415C-4974-97A6-85AEE173837A
InChIKey	wds:Q104252621-79F08799-671A-4639-99DA-52D6CB8C8D08
chemical formula	wds:Q104252621-88583939-F483-42E5-A6E0-9EE4BFDCBEDF
PubChem CID	wds:Q104252621-75E21612-E766-46E0-9A21-46F0BFA917F6
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID118701337
UniChem compound ID	145245511
canonical SMILES	O=C1OC2C(C1=C)C(OC(=O)C(O)(C)CCl)CC(=C)C3CC(O)C(O)(CCl)C23
InChI	InChI=1S/C19H24Cl2O7/c1-8-4-11(27-17(24)18(3,25)6-20)13-9(2)16(23)28-15(13)14-10(8)5-12(22)19(14,26)7-21/h10-15,22,25-26H,1-2,4-7H2,3H3/t10?,11-,12+,13?,14?,15-,18+,19+/m0/s1
InChIKey	NUVAJKJDTZTFLK-NDRINEROSA-N
chemical formula	C₁₉H₂₄Cl₂O₇
PubChem CID	118701337
mass	wds:Q104252621-402ED54C-83FD-4088-BADF-43BB554B58D9
mass	434.089908468 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q104252621
is subclass of of	CID 14021487 [(3aR,4S,6aR,8R,9S,9aS,9bR)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] (2S)-3-chloro-2-hydroxy-2-methylpropanoate (3aR,6abeta,9abeta,9balpha)-Decahydro-3,6-bismethylene-8alpha,9beta-dihydroxy-9-(chloromethyl)-4beta-[[(R)-3-chloro-2-hydroxy-2-methylpropanoyl]oxy]azuleno[4,5-b]furan-2(3H)-one [(3aR,4S,6aR,8R,9S,9aS,9bS)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] (2R)-3-chloro-2-hydroxy-2-methylpropanoate Chlorohyssopifolin A
is subclass of of	wds:Q27106153-B9D4D942-CAD6-43D4-AAF3-AA62792580E8 wds:Q105186037-0749BB6E-1278-4C28-999C-398907F6251B wds:Q105186039-09156782-6E0A-41D3-B2AB-9D625B99686A wds:Q105186040-51E8568F-A3EC-4024-A7BE-181875DC14F2 wds:Q105186042-7A33C7DF-504E-49C4-92AE-674C3C708306
is main subject of	Guaianolides from Centaurea sinaica Bisabolone derivatives and sesquiterpene lactones from centaurea species A chemotaxonomic study of sesquiterpene lactones from subtribe centaureinae of the compositae Sesquiterpene lactones from Centaurea alba and C. conifera Chromatography of twentysix sesquiterpene lactones fromCentaurea bella Sesquiterpene lactones from Centaurea solstitialis Guaianolides from Saussurea candicans Isolation and chromatography of 15-deoxyrepin and 25 other sesquiterpene lactones from Centaurea bella Trautv Sesquiterpene lactones. XXXVI. Sesquiterpene lactones in several subgenera of the genus Centaurea L. Guaianolides from Centaurea canariensis New Guaianolides fromCentaurea aegyptica Centaurepensin: A Cytotoxic Constituent of Centaurea solstitialis and C. repens (Asteraceae)
is main subject of	wds:Q79898846-01B15C6B-BC79-4A52-8F85-4A6C772E4B9D

Faceted Search & Find service v1.16.117 as of May 05 2024

Alternative Linked Data Documents: ODE Content Formats:

RDF

ODATA

Microdata

About

OpenLink Virtuoso version 07.20.3239 as of May 5 2024, on Linux (x86_64-centos_6-linux-gnu), Single-Server Edition (378 GB total memory, 183 GB memory in use)
Data on this page belongs to its respective rights holders.
Virtuoso Faceted Browser Copyright © 2009-2025 OpenLink Software