About: 2,3-Dihydrohelenalin

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About: 2,3-Dihydrohelenalin 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) cheemesch Verbindung (lb) 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)
rdfs:label	2,3-Dihydrohelenalin (en)
skos:prefLabel	2,3-Dihydrohelenalin (en)
name	2,3-Dihydrohelenalin (en)
isomeric SMILES	wds:Q83060758-477A2403-86CF-45C3-A1EB-629448F9EF5B
stereoisomer of	wds:Q83060758-10065BE0-A5AB-414F-A040-8D0898338819 wds:Q83060758-2A07686F-11F2-49AB-8C03-E4640B528DB3 wds:Q83060758-5C39FE8F-13D0-4BFD-B69E-3BABB77D54B2 wds:Q83060758-ACF93DF3-CE38-4CA1-9636-135724BFAEFB
isomeric SMILES	C[C@@H]1C[C@@H]2[C@H]([C@@H]([C@]3([C@H]1CCC3=O)C)O)C(=C)C(=O)O2
stereoisomer of	(3aR,5R,5aS,8aR,9S,9aR)-9-hydroxy-5,8a-dimethyl-1-methylidene-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione carpesiolin (3aS,5R,5aR,8aR,9S,9aS)-9-hydroxy-5,8a-dimethyl-1-methylidene-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione Allodesacetylconfertiflorin
instance of	wds:Q83060758-B80495E6-91D2-4ED9-91F2-088DACBAC812
instance of	type of chemical entity
subclass of	wds:Q83060758-A1A7FEC9-03F6-4AAA-B331-A1B22520EE64
subclass of	chemical substance
UniChem compound ID	wds:Q83060758-7541D256-6FC6-4418-AD39-078D3E41E075
CAS Registry Number	wds:Q83060758-57CEA1E1-08E9-46CB-B363-EA8261BC1DFA
canonical SMILES	wds:Q83060758-8B41B4CD-73F8-4303-A513-20A4FCA45D83
InChI	wds:Q83060758-3183CAB0-DD36-4A46-A41D-56C33C665971
InChIKey	wds:Q83060758-1AF7039E-70E2-4F6F-8E1F-F209171E35EE
chemical formula	wds:Q83060758-E4BC3BCE-B6DD-43C1-954A-F48FEDABE18E
DSSTox substance ID	wds:Q83060758-6802554D-E6F6-4783-80ED-C26486F17D6C
PubChem CID	wds:Q83060758-0EF6095B-7AE9-4757-9F95-AB84F59DC2F6
DSSTOX compound identifier	wds:Q83060758-FD509AA8-B5FE-47EC-9906-49AEC443611D
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID37128
UniChem compound ID	462148
CAS Registry Number	35412-73-8
canonical SMILES	C=C1C(=O)OC2CC(C)C3CCC(=O)C3(C)C(O)C12
InChI	InChI=1S/C15H20O4/c1-7-6-10-12(8(2)14(18)19-10)13(17)15(3)9(7)4-5-11(15)16/h7,9-10,12-13,17H,2,4-6H2,1,3H3/t7-,9+,10-,12-,13+,15+/m1/s1
InChIKey	IOUNDPHKKPZPKB-XEPQRQSNSA-N
chemical formula	C₁₅H₂₀O₄
DSSTox substance ID	DTXSID00188897
PubChem CID	37128
DSSTOX compound identifier	DTXCID60111388
mass	wds:Q83060758-B6022198-F8BC-4FD0-BF98-106616E5BBAF
mass	264.13615912 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q83060758
is stereoisomer of of	(3aR,5R,5aS,8aR,9S,9aR)-9-hydroxy-5,8a-dimethyl-1-methylidene-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione carpesiolin (3aS,5R,5aR,8aR,9S,9aS)-9-hydroxy-5,8a-dimethyl-1-methylidene-3a,4,5,5a,6,7,9,9a-octahydroazuleno[6,7-b]furan-2,8-dione Allodesacetylconfertiflorin
is stereoisomer of of	wds:Q105116893-792736BA-3440-4DBC-89E3-07EFEC1274C1 wds:Q27137680-344F386C-13F4-48AD-A147-03D6B2F72491 wds:Q105116892-6C1FC598-2743-4BA6-BF20-A9C4A2DA43B2 wds:Q83038920-9A2C5A3C-23F7-4D09-B9CB-790F68354006

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