About: Alopecurone E

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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 C₄₀H₄₀O₉

Attributes	Values
rdf:type	Item
description	groep van stereo-isomeren (nl) група стереоізомерів з хімічною формулою C₄₀H₄₀O₉ (uk) group of stereoisomers with the chemical formula C₄₀H₄₀O₉ (en)
rdfs:label	Alopecurone E (en)
skos:prefLabel	Alopecurone E (en)
name	Alopecurone E (en)
isomeric SMILES	wds:Q105229645-8F92CED1-713E-420D-9CF9-CAF273D2EAE8
isomeric SMILES	C=C(C)C(CC=C(C)C)Cc1c2c(c(O)c3c1O[C@@H](c1ccc(O)cc1)[C@H]3c1cc(O)cc(O)c1)C(=O)C[C@@H](c1ccc(O)cc1OC)O2
instance of	wds:Q105229645-91D248A6-5889-4EFA-9108-6BC52D9B114D
instance of	group of stereoisomers
subclass of	wds:Q105229645-3D8AB63B-9CC6-4D5F-8D90-ECA10326E63D wds:Q105229645-F71B492F-8ABD-4BE0-A8F1-CE0776BAD6EA
subclass of	6,8C-substituted flavanone 2,3,6-trimethylheptane monoterpenoid
found in taxon	wds:Q105229645-3883A4FC-5523-4B25-9CA2-5C60B66DE84B
found in taxon	Sophora jaubertii
UniChem compound ID	wds:Q105229645-85A92385-9873-42A5-8D54-53F6066BCD75
canonical SMILES	wds:Q105229645-CDEB043C-AC3E-45A9-AF38-C2E1CEDC6AC7
InChI	wds:Q105229645-0F7EFA1B-F112-46B9-9E1C-42E0BF6E29E0
InChIKey	wds:Q105229645-87435B7C-E517-4E1D-836D-F637B4E8CD50
chemical formula	wds:Q105229645-A000F89B-451F-4124-B8C0-9F32DC20DB49
PubChem CID	wds:Q105229645-F86B5E56-46B2-4AB0-A37E-161D7433903A
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID101915837
UniChem compound ID	97102133
canonical SMILES	O=C1C=2C(O)=C3C(OC(C4=CC=C(O)C=C4)C3C=5C=C(O)C=C(O)C5)=C(C2OC(C6=CC=C(O)C=C6OC)C1)CC(C(=C)C)CC=C(C)C
InChI	InChI=1S/C40H40O9/c1-20(2)6-7-23(21(3)4)16-30-39-35(31(45)19-33(48-39)29-13-12-26(42)18-32(29)47-5)37(46)36-34(24-14-27(43)17-28(44)15-24)38(49-40(30)36)22-8-10-25(41)11-9-22/h6,8-15,17-18,23,33-34,38,41-44,46H,3,7,16,19H2,1-2,4-5H3/t23?,33-,34-,38-/m0/s1
InChIKey	QXJNTDXKZVNKDH-GUMQMCFDSA-N
chemical formula	C₄₀H₄₀O₉
PubChem CID	101915837
mass	wds:Q105229645-FC4AA190-07A3-4DF3-A22F-0B5D8D106E26
mass	664.26723286 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105229645
is subclass of of	(2R,3R,7S)-3-(3,5-dihydroxyphenyl)-4-hydroxy-7-(4-hydroxy-2-methoxyphenyl)-2-(4-hydroxyphenyl)-9-[(2R)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]-2,3,6,7-tetrahydrofuro[3,2-g]chromen-5-one (2S,3S,7S)-3-(3,5-dihydroxyphenyl)-4-hydroxy-7-(4-hydroxy-2-methoxyphenyl)-2-(4-hydroxyphenyl)-9-[(2R)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]-2,3,6,7-tetrahydrofuro[3,2-g]chromen-5-one (2R,3S,7S)-3-(3,5-dihydroxyphenyl)-4-hydroxy-7-(4-hydroxy-2-methoxyphenyl)-2-(4-hydroxyphenyl)-9-[(2R)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]-2,3,6,7-tetrahydrofuro[3,2-g]chromen-5-one
is subclass of of	wds:Q105229649-4C2420F3-4C71-4823-B247-D06B2860474F wds:Q105229648-87F2976D-294D-4DCB-900D-0724F8A37268 wds:Q105229643-B725638E-457F-4684-910B-3DCEB58C36CA
is main subject of	Six flavonostilbenes and a flavanone in roots of Sophora alopecuroides
is main subject of	wds:Q104388470-694A3518-8A13-428B-86A2-7AEE0E578F37

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