About: [(2R,3S,4S,5R,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate

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About: [(2R,3S,4S,5R,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate 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) 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	[(2R,3S,4S,5R,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate (en)
skos:prefLabel	[(2R,3S,4S,5R,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate (en)
name	[(2R,3S,4S,5R,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate (en)
isomeric SMILES	wds:Q105124954-9F27C588-E927-4664-8239-BB4795B087CA
stereoisomer of	wds:Q105124954-80A1BB20-D263-4229-AAAB-B479B027332B wds:Q105124954-C9F29BF1-26D7-4BAD-B11F-3CEF77C11D11
isomeric SMILES	CCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)C(=CC[C@@H]4[C@@H]3CC[C@@]3(C)[C@H]4CC[C@@H]3[C@H](C)CC[C@H](CC)C(C)C)C2)[C@H](O)[C@@H](O)[C@@H]1O
stereoisomer of	sitoindoside I [(2R,3R,4R,5S,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate
instance of	wds:Q105124954-AD6890DE-0CA3-44B9-A1D0-3D2ED10ECEF0
instance of	type of chemical entity
subclass of	wds:Q105124954-458189E0-9008-4A14-9564-3112C7527685
subclass of	CID 13051622
found in taxon	wds:Q105124954-712A6844-506D-4D0D-B87E-FA9B6D4015B1 wds:Q105124954-82454A21-455A-4F1D-B718-7A1A62206BC9
found in taxon	Ficus carica Paris verticillata
UniChem compound ID	wds:Q105124954-DCD2FBB2-8E7C-4F39-8327-C5009114F66F
canonical SMILES	wds:Q105124954-65878605-06B4-4C5B-837D-9A5679EA7A57
InChI	wds:Q105124954-46964D01-CF47-4CD1-B323-4C01F64FDA67
InChIKey	wds:Q105124954-B34C8B20-A7A3-49AC-A4A9-5534C43F49BC
chemical formula	wds:Q105124954-CE218044-6900-4C5B-A1DF-BD6C2BD324C1
PubChem CID	wds:Q105124954-26DDA3A8-7325-4ED6-8923-ACE5EE217597
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID44593507
UniChem compound ID	609956
canonical SMILES	O=C(OCC1OC(OC2CC3=CCC4C(CCC5(C)C(CCC45)C(C)CCC(CC)C(C)C)C3(C)CC2)C(O)C(O)C1O)CCCCCCCCCCCCCCC
InChI	InChI=1S/C51H90O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-45(52)56-34-44-46(53)47(54)48(55)49(58-44)57-39-29-31-50(6)38(33-39)25-26-40-42-28-27-41(51(42,7)32-30-43(40)50)36(5)23-24-37(9-2)35(3)4/h25,35-37,39-44,46-49,53-55H,8-24,26-34H2,1-7H3/t36-,37+,39+,40+,41-,42+,43+,44-,46-,47+,48-,49-,50+,51-/m1/s1
InChIKey	JCLYMCVRBRHEHI-FLBTYZGGSA-N
chemical formula	C₅₁H₉₀O₇
PubChem CID	44593507
mass	wds:Q105124954-430DE0B7-CDBE-4A2F-9DDB-E131028C940D
mass	814.66865522 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105124954
is stereoisomer of of	sitoindoside I [(2R,3R,4R,5S,6R)-6-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl hexadecanoate
is stereoisomer of of	wds:Q27136065-0F713FC6-19E4-41EE-B50C-71163E9EC56D wds:Q105124966-AB99E396-9AC3-4C1B-A02E-F7C55FC28FD3
is main subject of	The constituents of Paris verticillata M.v. Bieb. Suppressors of cancer cell proliferation from fig (Ficus carica) resin: isolation and structure elucidation
is main subject of	wds:Q43688185-E5DB97F6-8CDD-4ECC-9172-0AAB9587CFA2 wds:Q105122706-A4F82FB1-B40D-4AD7-91D6-02CA923029CB

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