About: Macrophyllosaponin D

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About: Macrophyllosaponin D Goto Sponge NotDistinct Permalink

An Entity of Type : wikibase:Item, within Data Space : wikidata.demo.openlinksw.com associated with source document(s)

group of stereoisomers with the chemical formula C₄₆H₇₈O₁₇

Attributes	Values
rdf:type	Item
description	chemische verbinding (nl) group of stereoisomers with the chemical formula C₄₆H₇₈O₁₇ (en) група стереоізомерів з хімічною формулою C₄₆H₇₈O₁₇ (uk)
rdfs:label	Macrophyllosaponin D (en)
skos:prefLabel	Macrophyllosaponin D (en)
name	Macrophyllosaponin D (en)
isomeric SMILES	wds:Q82227871-20B7454A-E01C-4AC7-8B71-5C63591340BF
isomeric SMILES	CC1OC(O[C@H]2C[C@H](O)[C@]34C[C@]35CC[C@]3(C)C([C@H](C)CC[C@H](OC6OCC(O)C(O)C6OC6OCC(O)C(O)C6O)C(C)(C)O)CC[C@@]3(C)C5[C@@H](O)CC4C2(C)C)C(O)C(O)C1O
instance of	wds:Q82227871-1614FB8F-0A1A-493E-93E5-BD8A42D1C1F9
instance of	group of stereoisomers
subclass of	wds:Q82227871-373B8E84-2B6B-4FEA-9256-E9E0800016DA
subclass of	cycloartane triterpenoid
found in taxon	wds:Q82227871-416DC9A7-CB23-4A7C-8583-675B12B0B421
found in taxon	Astragalus oleifolius
UniChem compound ID	wds:Q82227871-B62C2C9A-7483-4FC2-BD28-E4FC2A99DE8B
CAS Registry Number	wds:Q82227871-C8418496-BDEC-45F4-9260-F43978F41187
canonical SMILES	wds:Q82227871-8D966CC3-19DC-4EB2-8F85-9971B3F34943
InChI	wds:Q82227871-538BB259-35A7-4965-8548-CE84483D1068
InChIKey	wds:Q82227871-46421CF9-6B4B-4E5D-8E5E-52765F4EF0A3
chemical formula	wds:Q82227871-D8F7DC73-34EA-4DFD-94BD-980A045D8655
DSSTox substance ID	wds:Q82227871-106B84E4-7E16-439E-BAAA-3B6DB881EE76
PubChem CID	wds:Q82227871-5EBEF146-9BF6-468D-B539-3F62EC19687D
DSSTOX compound identifier	wds:Q82227871-D9751C5B-D910-4E4D-8EA2-46282D4BE2B8
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID5352120
UniChem compound ID	49463287
CAS Registry Number	184104-63-0
canonical SMILES	OC1COC(OC2C(O)C(O)COC2OC(CCC(C)C3CCC4(C)C5C(O)CC6C(C)(C)C(OC7OC(C)C(O)C(O)C7O)CC(O)C86CC58CCC34C)C(O)(C)C)C(O)C1O
InChI	InChI=1S/C46H78O17/c1-20(9-10-28(42(5,6)57)61-40-36(32(53)25(49)18-59-40)63-38-34(55)31(52)24(48)17-58-38)22-11-12-44(8)37-23(47)15-26-41(3,4)29(62-39-35(56)33(54)30(51)21(2)60-39)16-27(50)46(26)19-45(37,46)14-13-43(22,44)7/h20-40,47-57H,9-19H2,1-8H3/t20-,21?,22?,23+,24?,25?,26?,27+,28+,29+,30?,31?,32?,33?,34?,35?,36?,37?,38?,39?,40?,43-,44+,45+,46-/m1/s1
InChIKey	BJQSXYMSMSHSIP-QMOAYLFTSA-N
chemical formula	C₄₆H₇₈O₁₇
DSSTox substance ID	DTXSID40417734
PubChem CID	5352120
DSSTOX compound identifier	DTXCID70368583
mass	wds:Q82227871-55A030AA-9E48-4B0C-9076-66C22F976AF7
mass	902.523901036 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q82227871
is main subject of	Unusual cycloartane glycosides from Astragalus eremophilus Four novel cycloartane glycosides from Astragalus oleifolius
is main subject of	wds:Q61049859-20F08327-5FC9-4930-9F8B-227BD37D67E3 wds:Q71840778-205B0CA3-6E67-4C4C-838D-2671D4C52F43

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