About: Methyl Ester Pandaroside C

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About: Methyl Ester Pandaroside C 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	Methyl Ester Pandaroside C (en)
skos:prefLabel	Methyl Ester Pandaroside C (en)
name	Methyl Ester Pandaroside C (en)
isomeric SMILES	wds:Q105183133-7F9D2101-7738-42D5-BC1E-B8C521A8987A
isomeric SMILES	COC(=O)[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@@H]4[C@@H]3CC[C@]3(C)C([C@H](C)CC(=O)CC(C)C)=C(O)C(=O)[C@H]43)C2)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
instance of	wds:Q105183133-B32FC56B-A679-4CB3-BB11-8C8888CA5EAF
instance of	type of chemical entity
subclass of	wds:Q105183133-73C07B11-539C-4175-B68C-EE4796D408D5
subclass of	Methyl 3,4-dihydroxy-6-[[16-hydroxy-10,13-dimethyl-17-(6-methyl-4-oxoheptan-2-yl)-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate
found in taxon	wds:Q105183133-863FA799-46B3-4797-A926-F0270909009D
found in taxon	Pandaros acanthifolium
UniChem compound ID	wds:Q105183133-789630BF-7420-486C-8D1D-4E4067F62FF1
canonical SMILES	wds:Q105183133-F3A5810D-D5F0-4C68-8D8B-A6C5B0624C43
InChI	wds:Q105183133-DA9F3EC7-9136-46A4-8FBB-6F38467A02D6
InChIKey	wds:Q105183133-A088E5DF-AF5B-483A-84D7-A0AE1E843C1E
chemical formula	wds:Q105183133-67219318-DCD0-4922-9167-EAEEE67FBA82
PubChem CID	wds:Q105183133-ACBB8CDD-B0A4-4CF2-9153-D2712717255C
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID44191619
UniChem compound ID	647122
canonical SMILES	O=C(OC)C1OC(OC2CCC3(C)C(CCC4C5C(=O)C(O)=C(C(C)CC(=O)CC(C)C)C5(C)CCC43)C2)C(OC6OC(CO)C(O)C(O)C6O)C(O)C1O
InChI	InChI=1S/C40H62O15/c1-17(2)13-20(42)14-18(3)25-28(44)29(45)26-22-8-7-19-15-21(9-11-39(19,4)23(22)10-12-40(25,26)5)52-38-35(32(48)31(47)34(54-38)36(50)51-6)55-37-33(49)30(46)27(43)24(16-41)53-37/h17-19,21-24,26-27,30-35,37-38,41,43-44,46-49H,7-16H2,1-6H3/t18-,19+,21+,22-,23+,24-,26+,27-,30+,31+,32+,33-,34+,35-,37+,38-,39+,40-/m1/s1
InChIKey	NPMOSNGWXNKPMG-ADKPZULSSA-N
chemical formula	C₄₀H₆₂O₁₅
PubChem CID	44191619
mass	wds:Q105183133-556BB0D2-9545-4FD8-86B7-C1016AF8F7DC
mass	782.408871284 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105183133
is main subject of	Antiprotozoal steroidal saponins from the marine sponge Pandaros acanthifolium Cytotoxic and haemolytic steroidal glycosides from the Caribbean sponge Pandaros acanthifolium Steroidal glycosides from the marine sponge Pandaros acanthifolium.
is main subject of	wds:Q39494328-1F9FECAE-9F27-4596-8BAB-FDF8E3A00F84 wds:Q45961294-FD7FA9EA-F31D-465F-AE18-8A6CE1727243 wds:Q42976246-26E1DC72-8524-478D-B1AF-450D528D4490

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