About: Davidiol A

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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	Davidiol A (en)
skos:prefLabel	Davidiol A (en)
name	Davidiol A (en)
isomeric SMILES	wds:Q105218770-09E97AFE-E6E4-4DCD-A2DD-8D87B5C2C164
stereoisomer of	wds:Q105218770-0093FCAC-A967-418B-8792-2127EAFCD1B3 wds:Q105218770-48C210AA-DBBF-4DFC-85F7-4FEEF432F694 wds:Q105218770-524BB9FC-DB0A-493A-A113-D539908E5D93 wds:Q105218770-76E35274-77D7-4A7A-BCF0-B2CA0752356D wds:Q105218770-78586559-1760-4025-A9F4-9709EB75D57C wds:Q105218770-7E3BF873-66C0-411A-B63A-F06ED605D3A4 wds:Q105218770-865CEA91-1900-47F8-AD82-C94AE9DA920A wds:Q105218770-C15ED430-B3DF-456A-8F93-A670DC3B67F6
isomeric SMILES	Oc1ccc([C@H]2Oc3cc(O)c4c5c3[C@@H]2c2cc(O)cc(O)c2[C@H](c2ccc(O)cc2)[C@H]5[C@H](c2cc(O)cc(O)c2)[C@H]4c2ccc(O)cc2)cc1
stereoisomer of	(1S,2R,3R,9R,10R,17R)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol (1R,2R,3S,9R,10R,17R)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol (1R,2S,3S,9R,10R,17R)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol ampelopsin C (1S,2R,3R,9R,10S,17S)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol (1S,2R,3R,9S,10S,17S)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol CID 71307315 (1S,2S,3R,9R,10R,17R)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol
instance of	wds:Q105218770-4342C9ED-07BD-4551-A0C8-698288FB8C40
instance of	type of chemical entity
subclass of	wds:Q105218770-36C170FA-9421-420B-AC00-A34F32841E23
subclass of	chemical substance
found in taxon	wds:Q105218770-6D24A850-335C-4EC0-A68F-ABBAB29718CC wds:Q105218770-CD5004FB-F08B-4016-8F2B-B8BE99548DF2 wds:Q105218770-DEC76149-9018-483B-9946-1DE86B28B550
found in taxon	Vitis heyneana Sophora davidii Shorea hemsleyana
UniChem compound ID	wds:Q105218770-A48FFD56-4997-4FC9-9DF8-9DB139628190
canonical SMILES	wds:Q105218770-08A9FEC0-4847-432E-A2E3-BE64781BA021
InChI	wds:Q105218770-8DD64E91-C041-4DEC-B00E-629C9C993CA0
InChIKey	wds:Q105218770-A6EF6954-7876-4C42-B7D2-B0FDEB15FC59
chemical formula	wds:Q105218770-043405C7-5A74-4F06-8044-4175AFB3D308
PubChem CID	wds:Q105218770-147EB246-3AF7-417E-AB28-9D2BADC7E609
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID11614520
UniChem compound ID	33503459
canonical SMILES	OC1=CC=C(C=C1)C2OC3=CC(O)=C4C5=C3C2C=6C=C(O)C=C(O)C6C(C7=CC=C(O)C=C7)C5C(C=8C=C(O)C=C(O)C8)C4C9=CC=C(O)C=C9
InChI	InChI=1S/C42H32O9/c43-23-7-1-19(2-8-23)33-35(22-13-26(46)15-27(47)14-22)40-34(20-3-9-24(44)10-4-20)36-29(16-28(48)17-30(36)49)37-39-32(18-31(50)38(33)41(39)40)51-42(37)21-5-11-25(45)12-6-21/h1-18,33-35,37,40,42-50H/t33-,34+,35-,37+,40+,42-/m1/s1
InChIKey	QDEHKEFWCRAFDN-HOWWATCWSA-N
chemical formula	C₄₂H₃₂O₉
PubChem CID	11614520
mass	wds:Q105218770-04C465BC-2AB7-4FCC-A018-E0FCD4C225B5
mass	680.204632604 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105218770
is stereoisomer of of	(1S,2R,3R,9R,10R,17R)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol (1R,2R,3S,9R,10R,17R)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol (1R,2S,3S,9R,10R,17R)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol ampelopsin C (1S,2R,3R,9R,10S,17S)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol (1S,2R,3R,9S,10S,17S)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol CID 71307315 (1S,2S,3R,9R,10R,17R)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol
is stereoisomer of of	wds:Q105218771-F5FBF670-FC86-4A80-8296-197D1B7F8BF2 wds:Q105218773-9FC61AE1-9D5C-4EEF-843B-0A2D2B939C72 wds:Q105218776-4ADF1E3C-4A1A-48E2-BEF8-4B20BE9B7EEA wds:Q105218777-377A4429-18A2-47DA-97AA-1F3F403D849F

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