About: (1S,2R,3R,7R,13R,14R,15S)-3,15-dihydroxy-17-(hydroxymethyl)-2,6,14-trimethyl-10-oxahexacyclo[7.7.1.02,7.03,15.07,14.013,17]heptadec-5-ene-4,11,16-trione

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About: (1S,2R,3R,7R,13R,14R,15S)-3,15-dihydroxy-17-(hydroxymethyl)-2,6,14-trimethyl-10-oxahexacyclo[7.7.1.02,7.03,15.07,14.013,17]heptadec-5-ene-4,11,16-trione Goto Sponge NotDistinct Permalink

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group of stereoisomers with the chemical formula C₂₀H₂₂O₇

Attributes	Values
rdf:type	Item
description	groep van stereo-isomeren (nl) group of stereoisomers with the chemical formula C₂₀H₂₂O₇ (en) група стереоізомерів з хімічною формулою C₂₀H₂₂O₇ (uk)
rdfs:label	(1S,2R,3R,7R,13R,14R,15S)-3,15-dihydroxy-17-(hydroxymethyl)-2,6,14-trimethyl-10-oxahexacyclo[7.7.1.02,7.03,15.07,14.013,17]heptadec-5-ene-4,11,16-trione (en)
skos:prefLabel	(1S,2R,3R,7R,13R,14R,15S)-3,15-dihydroxy-17-(hydroxymethyl)-2,6,14-trimethyl-10-oxahexacyclo[7.7.1.02,7.03,15.07,14.013,17]heptadec-5-ene-4,11,16-trione (en)
name	(1S,2R,3R,7R,13R,14R,15S)-3,15-dihydroxy-17-(hydroxymethyl)-2,6,14-trimethyl-10-oxahexacyclo[7.7.1.02,7.03,15.07,14.013,17]heptadec-5-ene-4,11,16-trione (en)
isomeric SMILES	wds:Q105228106-459F4CBF-6A51-4717-B3A1-022F55AC61EB
isomeric SMILES	CC1=CC(=O)[C@]2(O)[C@]3(O)C(=O)[C@H]4C5(CO)C6C[C@@]1([C@@]3(C)[C@@H]5CC(=O)O6)[C@@]42C
instance of	wds:Q105228106-8B8F8B81-9079-401B-894E-BFAD75D01ECC
instance of	group of stereoisomers
subclass of	wds:Q105228106-98EC1BCB-DBFD-4F78-BB35-44FCB4268B89
subclass of	chemical substance
canonical SMILES	wds:Q105228106-B7540BE7-439A-4B0A-AF4C-0D0374E94B4F
InChI	wds:Q105228106-61C44F89-6B7A-4D94-8DF9-6C848EAEB252
InChIKey	wds:Q105228106-0566FFE0-EB33-4A4E-B51E-57298754A3AD
chemical formula	wds:Q105228106-5BC292EA-06CF-45CA-BA2C-EA428328DC94
PubChem CID	wds:Q105228106-892E48DA-166B-40E3-9211-200A9988C3C4
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID163193326
canonical SMILES	O=C1OC2CC34C(=CC(=O)C5(O)C6(O)C(=O)C(C53C)C2(CO)C(C1)C64C)C
InChI	InChI=1S/C20H22O7/c1-8-4-10(22)19(25)16(3)13-14(24)20(19,26)15(2)9-5-12(23)27-11(6-18(8,15)16)17(9,13)7-21/h4,9,11,13,21,25-26H,5-7H2,1-3H3/t9-,11?,13+,15+,16+,17?,18+,19+,20-/m0/s1
InChIKey	QUDGSOQXSJGXMH-UHIUOQOBSA-N
chemical formula	C₂₀H₂₂O₇
PubChem CID	163193326
mass	wds:Q105228106-BD4E50C9-EE6E-4717-851E-EB6DFFB26058
mass	374.136553044 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105228106
is subclass of of	Shinjulactone C (1S,2R,3R,7R,9R,13R,14R,15S,17S)-3,15-dihydroxy-17-(hydroxymethyl)-2,6,14-trimethyl-10-oxahexacyclo[7.7.1.02,7.03,15.07,14.013,17]heptadec-5-ene-4,11,16-trione
is subclass of of	wds:Q105228105-10E5A6EA-F648-4ED8-9C10-A2FF49F9D6B6 wds:Q105228104-26B254B8-A85C-4C11-A78D-969DA7732077

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