About: 3-[(3S,5S,8R,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one

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About: 3-[(3S,5S,8R,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one 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	3-[(3S,5S,8R,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one (en)
skos:prefLabel	3-[(3S,5S,8R,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one (en)
name	3-[(3S,5S,8R,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one (en)
isomeric SMILES	wds:Q105310215-A569D438-D8D7-40D0-BCD4-84A6F9F85D95
stereoisomer of	wds:Q105310215-058FB646-E232-4874-B2CE-7E9DBA8D1A6B wds:Q105310215-592C1E26-C568-4DE9-B014-558B9729763E wds:Q105310215-72958973-7E04-45FA-A6AB-8E25CFCF5371 wds:Q105310215-DB1C8AE0-F0D8-4C1D-B39D-18A743FAF943 wds:Q105310215-F7E25510-172D-4C84-B2EC-4F08C18929F2
isomeric SMILES	C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(CO)[C@@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)[C@H](O)[C@H](O)[C@@H]1O
stereoisomer of	3-O-alpha-L-Rhamnopyranosylcannogenol 3-[(3S,5S,8R,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one 3-[(3S,5R,8S,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one 3-[(3S,5R,8R,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one Coroglaucigenin-3-o-alpha-L-rhamnopyranoside
instance of	wds:Q105310215-54423E87-B5F8-4619-AA67-419F89BBCCF2
instance of	type of chemical entity
subclass of	wds:Q105310215-1882E29D-2CD8-47CB-94DA-CF324AC9D243 wds:Q105310215-AB717978-335B-42EC-8C25-38DA0787AAB6 wds:Q105310215-AF1C433E-7775-4B9A-9874-1326E8692C3D
subclass of	Frugoside 3-[(6-Deoxyhexopyranosyl)oxy]-14,19-dihydroxycard-20(22)-enolide 3-[14-hydroxy-10-(hydroxymethyl)-13-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
found in taxon	wds:Q105310215-12BE1991-D10B-4B10-9FD2-C85531956CA8 wds:Q105310215-6E1DD00C-3B0A-4769-B0D8-010343E83A52 wds:Q105310215-E17BAD5A-201C-42C8-AAB3-706177956E68
found in taxon	Asclepias incarnata Mallotus nudiflorus Calotropis procera
UniChem compound ID	wds:Q105310215-55606339-9F4C-4745-A9D0-3F32C41D4496
CAS Registry Number	wds:Q105310215-860F2E49-D707-4C88-B1AA-266CD49981C0
canonical SMILES	wds:Q105310215-702F7D18-7179-485A-9EC1-992861655513
InChI	wds:Q105310215-F6D6A1FF-1419-4A5A-80EA-4428B6B78283
InChIKey	wds:Q105310215-B6EC0595-1A1D-4309-A44C-D65331E0E3A2
chemical formula	wds:Q105310215-EBD994AD-9501-4FAF-85FF-6490C86D17FA
PubChem CID	wds:Q105310215-E91FF57F-6282-4206-9E9F-D2BC7F078866
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID154496583
UniChem compound ID	153390534
CAS Registry Number	546-02-1
canonical SMILES	O=C1OCC(=C1)C2CCC3(O)C4CCC5CC(OC6OC(C)C(O)C(O)C6O)CCC5(CO)C4CCC23C
InChI	InChI=1S/C29H44O9/c1-15-23(32)24(33)25(34)26(37-15)38-18-5-9-28(14-30)17(12-18)3-4-21-20(28)6-8-27(2)19(7-10-29(21,27)35)16-11-22(31)36-13-16/h11,15,17-21,23-26,30,32-35H,3-10,12-14H2,1-2H3/t15-,17+,18+,19-,20+,21-,23-,24-,25-,26+,27-,28-,29+/m1/s1
InChIKey	WPVGSIBYLZQSIK-ZAFSJQLXSA-N
chemical formula	C₂₉H₄₄O₉
PubChem CID	154496583
mass	wds:Q105310215-20B73347-761A-45D3-BC69-7229617BB241
mass	536.298532988 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105310215
is stereoisomer of of	3-O-alpha-L-Rhamnopyranosylcannogenol 3-[(3S,5S,8R,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one 3-[(3S,5R,8S,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one 3-[(3S,5R,8R,9S,10R,13R,14S,17R)-14-hydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one Coroglaucigenin-3-o-alpha-L-rhamnopyranoside
is stereoisomer of of	wds:Q105310209-AE807C06-39D6-4794-935D-E620C143B018 wds:Q105310210-F9321CA7-EB53-489F-8767-17D2F2E25E58 wds:Q105310214-8CEE65CE-0DD9-4519-A628-C937E5D0D11F wds:Q27155112-4204644D-A0DF-4504-847D-D03AD9532638 wds:Q105310206-9DAD7137-BDA6-4958-9AF6-98718B53E790
is main subject of	Cardenolide and oxypregnane glycosides from the root of Asclepias incarnata L Cardenolides and Cardiac Aglycone from the Stem Bark ofTrewia nudiflora

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