About: 8-O-Acetylshanzhiside methyl ester

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About: 8-O-Acetylshanzhiside methyl ester 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	8-O-Acetylshanzhiside methyl ester (en)
skos:prefLabel	8-O-Acetylshanzhiside methyl ester (en)
name	8-O-Acetylshanzhiside methyl ester (en)
isomeric SMILES	wds:Q72435813-E7587AF0-5A8A-432B-94E7-A9B9FEE87A82
stereoisomer of	wds:Q72435813-995B8148-90F0-41E0-9016-51EDCB9E224D wds:Q72435813-EDC1BB57-E642-400A-AEB8-F443985D47F7
isomeric SMILES	CC(=O)O[C@]1(C[C@H]([C@H]2[C@@H]1[C@@H](OC=C2C(=O)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)C
stereoisomer of	methyl (1S,4aS,5R,7S,7aS)-7-acetyloxy-5-hydroxy-7-methyl-1-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate 6,9-epi-8-O-Acetylshanziside
instance of	wds:Q72435813-70CE633A-AC35-412D-A520-729815EB2969
instance of	type of chemical entity
subclass of	wds:Q72435813-4A23AEF6-F718-4584-8770-21C0764A8F1A wds:Q72435813-5A0A81C8-5EFA-4E9E-87E5-F20A78957684
subclass of	methyl (4aR,7S,7aS)-7-acetyloxy-5-hydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate methyl 7-acetyloxy-5-hydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate
found in taxon	wds:Q72435813-1478DB7C-96B5-4190-ACDB-D123A0B4FE6A wds:Q72435813-58843471-6B5C-4545-A704-F308733A3D90 wds:Q72435813-5B18F4A7-C517-4E28-B317-2FC180DDCEF5 wds:Q72435813-809A3D69-9C74-4CE4-8DBB-05958C30A133 wds:Q72435813-98F25CDD-6982-4E0B-B9E5-1A0EB21520A6 wds:Q72435813-A17ADBFB-A3BD-4472-8B82-078DCEAB0F3F wds:Q72435813-B7E87354-C8C3-409D-A538-F7FE9959C1C6 wds:Q72435813-E6EAADFE-50AD-47FB-98A6-F714AC7BFCDD wds:Q72435813-F2A00D21-5E40-4951-809F-9F431A374C62 wds:Q72435813-F4E0E5FB-C376-4E59-9A53-5DB1F5F88B4A
found in taxon	Barleria prionitis henbit deadnettle Barleria lupulina Salvia digitaloides Lamium garganicum Phlomis spinidens Phlomis rigida Phlomoides younghushandii Phlomoides umbrosa Phlomoides rotata
UniChem compound ID	wds:Q72435813-2914B460-14BC-4186-B56E-A3E6B9D40556
Probes And Drugs ID	wds:Q72435813-3B283053-19E1-4B4C-8C46-5B0F9D7B763F
CAS Registry Number	wds:Q72435813-A137E203-E0E7-4C45-B883-99871837DCD7
canonical SMILES	wds:Q72435813-B03D4684-D69B-4946-8884-16B98E6C0152
InChI	wds:Q72435813-C8ED3750-0F57-4467-BD38-81E7FCDEE6BA
InChIKey	wds:Q72435813-347B4F18-D408-4867-8AD8-DD7C0E316C6E
chemical formula	wds:Q72435813-9322F602-B345-46A5-99E7-58AB9208B43B
DSSTox substance ID	wds:Q72435813-3B77FACB-B83E-4143-8931-1DF93BCCA777
PubChem CID	wds:Q72435813-67524712-1953-4242-8155-1A98741F642C
DSSTOX compound identifier	wds:Q72435813-2BADFD89-F110-4A3C-8F95-228EFACCFEA2
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID162823
UniChem compound ID	355556
Probes And Drugs ID	PD087890
CAS Registry Number	57420-46-9
canonical SMILES	O=C(OC)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1C(O)CC3(OC(=O)C)C
InChI	InChI=1S/C19H28O12/c1-7(21)31-19(2)4-9(22)11-8(16(26)27-3)6-28-17(12(11)19)30-18-15(25)14(24)13(23)10(5-20)29-18/h6,9-15,17-18,20,22-25H,4-5H2,1-3H3/t9-,10-,11+,12-,13-,14+,15-,17+,18+,19+/m1/s1
InChIKey	ARFRZOLTIRQFCI-NGQYDJQZSA-N
chemical formula	C₁₉H₂₈O₁₂
DSSTox substance ID	DTXSID80206008
PubChem CID	162823
DSSTOX compound identifier	DTXCID40128499
mass	wds:Q72435813-AD6011CC-9609-440E-8002-EA28A2E15233
mass	448.158076336 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q72435813
is stereoisomer of of	methyl (1S,4aS,5R,7S,7aS)-7-acetyloxy-5-hydroxy-7-methyl-1-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate 6,9-epi-8-O-Acetylshanziside
is stereoisomer of of	wds:Q104917282-1EBA2B6C-4C4C-4C6B-B666-BF849BD2095E wds:Q104917293-FD5D62C2-EFC5-4589-8F29-ADCCEBCCF1A2
is main subject of	Chemotaxonomy of the acanthaceae. Iridoids and quaternary amines Iridoid glucosides from Phlomis rotata Three New Monoterpene Glucosides fromLamium amplexicaule New iridoids from the medicinal plant Barleria prionitis with potent activity against respiratory syncytial virus Iridoid glucosides from Lamium amplexicaule. Sweet and bitter glycosides of the Chinese plant drug, Bai-Yun-Shen (roots of Salvia digitaloides). Benzoxazinoids and iridoid glucosides from four Lamium species Phlorigidosides A-C, iridoid glucosides from Phlomis rigida Iridoid glycosides from Phlomis younghusbandii roots Iridoid glucosides from Barleria lupulina Phlomisflavosides A and B, new flavonol bisglycosides from Phlomis spinidens. Iridoids from Crescentia alata The Minor Iridoid Glucosides of Barleria lupulina: Isolation, Crystal Structure and Plant Growth-Inhibiting Properties of 6-O-Acetylshanzhiside Methyl Ester Iridoid glucosides from Barleria lupulina Iridoid Glucosides from the Flowers ofBarleria lupulina Iridoid Glucosides of Barleria Lupulina Iridoid glycosides from Barleria lupulina
is main subject of	wds:Q104386514-37E9287F-1D4A-4D6A-B155-6097F2EE6565 wds:Q104911127-CBE4B47B-BB1B-4AD3-8A23-BCC98CE13CB8 wds:Q104917289-E46A8CBC-AF39-496E-9035-F597D5195F91 wds:Q104917283-D49722DC-BEEC-4568-9CF0-273D3DDCD98E wds:Q43714576-21A5B636-AA2B-4EAB-8484-5D9669886842 wds:Q74498959-6262FFD5-83B5-4F8F-BF66-7FBE21803427 wds:Q104917287-75C0782B-8154-4C5F-9933-53A3B71E6C93 wds:Q104386512-BC15B79D-9516-4714-AE88-79AD4A8C2C37 wds:Q44663396-CD5DC817-C5CB-4BEA-93B5-46D862029318 wds:Q44687688-F7129548-F75F-4185-BA4E-DD3E93C4FEAD

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