About: (4aS)-5,8-dihydroxy-7-[(2S)-2-hydroxypropyl]-1,2,4a-trimethyl-4H-phenanthrene-3,6-dione

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About: (4aS)-5,8-dihydroxy-7-[(2S)-2-hydroxypropyl]-1,2,4a-trimethyl-4H-phenanthrene-3,6-dione Goto Sponge NotDistinct Permalink

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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	(4aS)-5,8-dihydroxy-7-[(2S)-2-hydroxypropyl]-1,2,4a-trimethyl-4H-phenanthrene-3,6-dione (en)
skos:prefLabel	(4aS)-5,8-dihydroxy-7-[(2S)-2-hydroxypropyl]-1,2,4a-trimethyl-4H-phenanthrene-3,6-dione (en)
name	(4aS)-5,8-dihydroxy-7-[(2S)-2-hydroxypropyl]-1,2,4a-trimethyl-4H-phenanthrene-3,6-dione (en)
isomeric SMILES	wds:Q105381306-F01E9615-66B6-495C-9F06-73EE420A095B
isomeric SMILES	CC1=C(C)C2=CC=C3C(O)=C(C[C@H](C)O)C(=O)C(O)=C3[C@@]2(C)CC1=O
instance of	wds:Q105381306-660B23C1-9B50-4773-8B67-46CB4D604691
instance of	type of chemical entity
subclass of	wds:Q105381306-7058AE98-F589-4B12-B47E-E365D02DC339
subclass of	17(15→16)-abeoabietanes
found in taxon	wds:Q105381306-11DAB297-EF9B-437E-81AF-F03D3DC063CE wds:Q105381306-6F95DC5F-0BBD-4155-BCC1-7186A88B573D
found in taxon	Plectranthus barbatus Coleus barbatus
UniChem compound ID	wds:Q105381306-777ED1EF-5AEB-4A18-81E5-6C9E98528AAB
canonical SMILES	wds:Q105381306-CD84A50B-93BD-4CC5-896A-B32D414583E9
InChI	wds:Q105381306-1107E8EB-3FFC-4971-8571-0F9213CB8353
InChIKey	wds:Q105381306-E7CBA80B-B430-4936-941D-A6A561AFA1CD
chemical formula	wds:Q105381306-7C5F0A8A-9663-4D2A-9C6E-F2DFC5A253DA
PubChem CID	wds:Q105381306-967918F8-9426-4D50-BB23-FE7BDF76D714
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID95240134
UniChem compound ID	106266807
canonical SMILES	O=C1C(O)=C2C(=CC=C3C(=C(C(=O)CC32C)C)C)C(O)=C1CC(O)C
InChI	InChI=1S/C20H22O5/c1-9(21)7-13-17(23)12-5-6-14-10(2)11(3)15(22)8-20(14,4)16(12)19(25)18(13)24/h5-6,9,21,23,25H,7-8H2,1-4H3/t9-,20-/m0/s1
InChIKey	ZPXWCKGSWWRWCO-LXGOIASLSA-N
chemical formula	C₂₀H₂₂O₅
PubChem CID	95240134
mass	wds:Q105381306-7DD17A7F-7523-4342-9BE2-D8B22561C528
mass	342.146723804 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105381306
is main subject of	Diterpenoids fromcoleus somaliensis(S. Moore): Coleons G, and J wd:Q105381304 Struktur von Coleon E, einem neuen diterpenoiden Methylenchino aus derColeus barbatus-Gruppe (Labiatae)
is main subject of	wds:Q105381305-C33E51D4-B251-4E38-8219-2E1C9B673CA0 wds:Q104998260-2F69D915-2F2D-4775-9085-EA8809D4596C wds:Q105381304-BAD56802-D880-491E-92EF-5914B6929328

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