About: calicoferol E

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About: calicoferol E 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	химическое соединение (ru) chemical compound (en) composé chimique (fr) compositum chemicum (la) chemische Verbindung (de) chemische verbinding (nl) compuestu químicu (ast) хімічна сполука (uk) রাসায়নিক যৌগ (bn)
rdfs:label	calicoferol E (en)
skos:prefLabel	calicoferol E (en)
name	calicoferol E (en)
isomeric SMILES	wds:Q76294401-E030D9DC-89CF-4624-9DA0-BD82E2822600
isomeric SMILES	CC1=C(C=C(C=C1)O)CC[C@H]2[C@@H]3CC[C@@H]([C@]3(CCC2=O)C)[C@H](C)CCCC(C)C
instance of	wds:Q76294401-7A799865-D846-4009-90E1-91115D7FF4BA
instance of	type of chemical entity
subclass of	wds:Q76294401-032CAEAE-E0A4-46A3-A2B3-A19D69141B5D
subclass of	9,10-secocholestane steroid
found in taxon	wds:Q76294401-A000EE62-EA64-4966-8936-B86BAAE02D2E
found in taxon	Muricella
UniChem compound ID	wds:Q76294401-19D483CA-CF78-4182-8F3D-1641E2C13763
canonical SMILES	wds:Q76294401-A417DFE8-9DBA-4285-8D12-FC8EF69A9C67
InChI	wds:Q76294401-B98F5F98-D83D-40EA-A6F3-500F8C16EE86
InChIKey	wds:Q76294401-56F6503E-580C-48F0-B80B-12D285C87585
chemical formula	wds:Q76294401-0A742F04-5A32-42D4-A705-506A25DA0D39
PubChem CID	wds:Q76294401-7762C962-69E0-44DC-8823-01F154F55C05
ChEBI ID	wds:Q76294401-60742ADD-37AD-4670-A0B2-6FC40EDD847C
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID5283685
ChEBI ID	http://purl.obolibrary.org/obo/CHEBI_190375
UniChem compound ID	215555
canonical SMILES	O=C1CCC2(C)C(CCC2C(C)CCCC(C)C)C1CCC3=CC(O)=CC=C3C
InChI	InChI=1S/C27H42O2/c1-18(2)7-6-8-20(4)24-13-14-25-23(26(29)15-16-27(24,25)5)12-10-21-17-22(28)11-9-19(21)3/h9,11,17-18,20,23-25,28H,6-8,10,12-16H2,1-5H3/t20-,23+,24-,25+,27-/m1/s1
InChIKey	OZROZYIBIZOAQQ-DLBXBJKMSA-N
chemical formula	C₂₇H₄₂O₂
PubChem CID	5283685
ChEBI ID	190375
LIPID MAPS ID	wds:Q76294401-B357790D-43E0-4B73-92AD-8755903549D3
LIPID MAPS ID	LMST03020157
mass	wds:Q76294401-8E1C76CA-FC1C-41E2-9B69-D7E53ED66D9E
mass	398.318480584 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q76294401
is main subject of	New secosteroids from an undescribed gorgonian of the genus Muricella
is main subject of	wds:Q71832679-EFEA02C2-6A02-4F68-B18A-7A951312BDB4

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