dioscin

chemical compound

Wikidata entity: Q5807682

C₄₅H₇₂O₁₆ (P274)


Quantities

P2067mass868.482036

P233 canonical SMILES String CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)OC9C(C(C(C(O9)C)O)O)O)C)C)C)OC1 ???
P703 found in taxon ... Q27938 (Welsh onion) Welsh onion
P703 found in taxon ... Q133205 (Trigonella foenum-graecum) Trigonella foenum-graecum
P703 found in taxon ... Q134359 (Aspergillus fumigatus) Aspergillus fumigatus
P703 found in taxon ... Q161378 (Dioscorea communis) Dioscorea communis
P703 found in taxon ... Q161747 (Chamaerops humilis) Chamaerops humilis
P703 found in taxon ... Q164097 (Rhapis excelsa) Rhapis excelsa
P703 found in taxon ... Q235889 (Tribulus terrestris) Tribulus terrestris
P703 found in taxon ... Q163095 (Smilax china) Smilax china
P703 found in taxon ... Q148995 (Allium ampeloprasum) Allium ampeloprasum
P703 found in taxon ... Q157952 (Dracaena draco) Dracaena draco
P703 found in taxon ... Q158383 (Trachycarpus fortunei) Trachycarpus fortunei
P703 found in taxon ... Q309632 (Dioscorea villosa) Dioscorea villosa
P703 found in taxon ... Q5279587 (Dioscorea mexicana) Dioscorea mexicana
P703 found in taxon ... Q5279588 (Dioscorea japonica) Dioscorea japonica
P703 found in taxon ... Q3038475 (Dracaena concinna) Dracaena concinna
P703 found in taxon ... Q3539177 (Trillium erectum) Trillium erectum
P703 found in taxon ... Q1548077 (Trillium grandiflorum) Trillium grandiflorum
P703 found in taxon ... Q500857 (Borassus flabellifer) Borassus flabellifer
P703 found in taxon ... Q617269 (Rhapis humilis) Rhapis humilis
P703 found in taxon ... Q5279593 (Dioscorea polystachya) Dioscorea polystachya
P703 found in taxon ... Q7137387 (Paris polyphylla) Paris polyphylla
P703 found in taxon ... Q7844269 (Triteleia hyacinthina) Triteleia hyacinthina
P703 found in taxon ... Q4121066 (Clintonia udensis) Clintonia udensis
P703 found in taxon ... Q4162026 (Dioscorea nipponica) Dioscorea nipponica
P703 found in taxon ... Q5279583 (Dioscorea composita) Dioscorea composita
P703 found in taxon ... Q10899151 (Dracaena cochinchinensis) Dracaena cochinchinensis
P703 found in taxon ... Q10905961 (Paris polyphylla var. chinensis) Paris polyphylla var. chinensis
P703 found in taxon ... Q10960205 (Dioscorea parviflora) Dioscorea parviflora
P703 found in taxon ... Q10802112 (Dioscorea collettii) Dioscorea collettii
P703 found in taxon ... Q10866823 (Dioscorea deltoidea) Dioscorea deltoidea
P703 found in taxon ... Q15227039 (Polygonatum zanlanscianense) Polygonatum zanlanscianense
P703 found in taxon ... Q15227293 (Dioscorea althaeoides) Dioscorea althaeoides
P703 found in taxon ... Q15227296 (Dioscorea futschauensis) Dioscorea futschauensis
P703 found in taxon ... Q11150362 (Dracaena cambodiana) Dracaena cambodiana
P703 found in taxon ... Q11177408 (Dioscorea panthaica) Dioscorea panthaica
P703 found in taxon ... Q12840920 (Polygonatum kingianum) Polygonatum kingianum
P703 found in taxon ... Q11046800 (Dioscorea tokoro) Dioscorea tokoro
P703 found in taxon ... Q11054848 (Smilax menispermoidea) Smilax menispermoidea
P703 found in taxon ... Q15227298 (Dioscorea gracillima) Dioscorea gracillima
P703 found in taxon ... Q15227310 (Dioscorea zingiberensis) Dioscorea zingiberensis
P703 found in taxon ... Q15239254 (Smilax lebrunii) Smilax lebrunii
P703 found in taxon ... Q21304319 (Urochloa decumbens) Urochloa decumbens
P703 found in taxon ... Q21877561 (Tamus communis) Tamus communis
P703 found in taxon ... Q42744437 (Hellenia lacera) Hellenia lacera
P703 found in taxon ... Q50840789 (Dioscorea pseudojaponica) Dioscorea pseudojaponica
P703 found in taxon ... Q85666301 (Dracaena hanningtonii) Dracaena hanningtonii
P703 found in taxon ... Q15248131 (Ophiopogon intermedius) Ophiopogon intermedius
P703 found in taxon ... Q15324975 (Costus afer) Costus afer
P703 found in taxon ... Q15471904 (Melilotus tauricus) Melilotus tauricus
P703 found in taxon ... Q15522064 (Maianthemum atropurpureum) Maianthemum atropurpureum
P703 found in taxon ... Q15600357 (Dioscorea spongiosa) Dioscorea spongiosa
P703 found in taxon ... Q15604981 (Dioscorea saxatilis) Dioscorea saxatilis
P703 found in taxon ... Q15613087 (Dioscorea sinoparviflora) Dioscorea sinoparviflora
P703 found in taxon ... Q21304303 (Urochloa eminii) Urochloa eminii
P703 found in taxon ... Q7540 (???) ???
P1552 has characteristic ... Q1517187 (bitterness) bitterness
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)O)O[C@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)C)C)C)OC1 ???
P3364 stereoisomer of ... Q105289795 (Collettinside III) Collettinside III
P3364 stereoisomer of ... Q105289797 ((25R)-3beta-[2-O,4-O-Bis(alpha-L-rhamnopyranosyl)-alpha-D-glucopyranosyloxy]spirosta-5-ene) (25R)-3beta-[2-O,4-O-Bis(alpha-L-rhamnopyranosyl)-alpha-D-glucopyranosyloxy]spirosta-5-ene
P3364 stereoisomer of ... Q105289800 (Borassoside E) Borassoside E
P3364 stereoisomer of ... Q105289791 (???) ???
P3364 stereoisomer of ... Q105289792 (???) ???
P3364 stereoisomer of ... Q105289794 (???) ???
P3364 stereoisomer of ... Q105289799 (???) ???
P3364 stereoisomer of ... Q110177900 (???) ???
P279 subclass of ... Q77806815 (spirostans) spirostans
External Ids
P231CAS Registry Number19057-60-4
P683ChEBI ID74023
P592ChEMBL IDCHEMBL507001
P661ChemSpider ID140549
P8494DSSTOX compound identifierDTXCID101331877
P3117DSSTox substance IDDTXSID50903916
P1417Encyclopædia Britannica Online IDscience/dioscin
P2671Google Knowledge Graph ID/g/122tpd1x
P595Guide to Pharmacology Ligand ID840
P234InChIInChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19-,20+,21+,22+,24+,25-,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36-,37+,38-,39-,40+,41+,42-,43+,44+,45-/m1/s1
P235InChIKeyVNONINPVFQTJOC-ZGXDEBHDSA-N
P665KEGG IDC08897
P2064KNApSAcK IDC00003575
P2063LIPID MAPS IDLMST01080053
P6689MassBank accession IDMSBNK-Fiocruz-FIO00889
P6689MassBank accession IDMSBNK-Fiocruz-FIO00890
P6689MassBank accession IDMSBNK-Fiocruz-FIO00891
P6689MassBank accession IDMSBNK-Fiocruz-FIO00892
P6689MassBank accession IDMSBNK-Fiocruz-FIO00893
P11199Probes And Drugs IDPD012045
P662PubChem CID119245
P2877SureChEMBL ID526528
P11089UniChem compound ID474065
P652UNII3B95U4OLWV

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log id: 4840723