Q105158417

chemical compound

Wikidata entity: Q105158417

C₄₅H₇₂O₁₆ (P274)

Quantities

P2067mass868.482036224

P233 canonical SMILES String OCC1OC(OC2CC3=CCC4C(CCC5(C)C4CC6OC7(OCC(C)CC7)C(C)C65)C3(C)CC2)C(OC8OC(C)C(O)C(O)C8O)C(OC9OC(C)C(O)C(O)C9O)C1O ???
P703 found in taxon ... Q1399941 (Asparagus setaceus) Asparagus setaceus
P703 found in taxon ... Q28934742 (Asparagus plumosus) Asparagus plumosus
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String C[C@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H]6O[C@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C ???
P3364 stereoisomer of ... Q105158412 (Taccaoside) Taccaoside
P3364 stereoisomer of ... Q105158414 ([(25R)-Spirosta-5-ene-3beta-yl]2-O,3-O-di-alpha-L-rhamnopyranosyl-beta-D-glucopyranoside) [(25R)-Spirosta-5-ene-3beta-yl]2-O,3-O-di-alpha-L-rhamnopyranosyl-beta-D-glucopyranoside
P3364 stereoisomer of ... Q105158415 (???) ???
P279 subclass of ... Q105158413 (2-[3-Hydroxy-2-(hydroxymethyl)-6-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl)oxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-4-yl]oxy-6-methyloxane-3,4,5-triol) 2-[3-Hydroxy-2-(hydroxymethyl)-6-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl)oxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-4-yl]oxy-6-methyloxane-3,4,5-triol
External Ids
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(60-41-37(53)35(51)32(48)22(4)56-41)38(33(49)29(17-46)58-42)59-40-36(52)34(50)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+/m0/s1
P235InChIKeyLWMZJBVLZFGRJF-YMUSTUJBSA-N
P662PubChem CID162929502

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