3beta-(beta-D-Glucopyranosyloxy)-5alpha-arbora-9(11)-ene-2alpha,7beta,19alpha-triol 2-acetate

chemical compound

Wikidata entity: Q105113434

C₃₈H₆₂O₁₀ (P274)

Quantities

P2067mass678.434298184

P233 canonical SMILES String O=C(OC1CC2(C3=CCC4(C)C5C(O)CC(C(C)C)C5(C)CCC4(C)C3C(O)CC2C(C)(C)C1OC6OC(CO)C(O)C(O)C6O)C)C ???
P703 found in taxon ... Q15251742 (Rubia yunnanensis) Rubia yunnanensis
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String CC(=O)O[C@@H]1C[C@]2(C)C3=CC[C@]4(C)[C@H]5[C@H](O)C[C@@H](C(C)C)[C@]5(C)CC[C@@]4(C)[C@@H]3[C@@H](O)C[C@H]2C(C)(C)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O ???
P3364 stereoisomer of ... Q105113431 (???) ???
P3364 stereoisomer of ... Q105113432 (???) ???
P279 subclass of ... Q105113433 ([1,6-Dihydroxy-3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysen-10-yl] acetate) [1,6-Dihydroxy-3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysen-10-yl] acetate
External Ids
P234InChIInChI=1S/C38H62O10/c1-18(2)21-14-23(42)31-35(21,6)12-13-37(8)27-20(10-11-38(31,37)9)36(7)16-24(46-19(3)40)32(34(4,5)26(36)15-22(27)41)48-33-30(45)29(44)28(43)25(17-39)47-33/h10,18,21-33,39,41-45H,11-17H2,1-9H3/t21-,22-,23+,24+,25+,26-,27-,28+,29-,30+,31-,32-,33-,35-,36+,37-,38+/m0/s1
P235InChIKeyIIEZTQGGXCNWOJ-USSCVGIMSA-N
P662PubChem CID101243333
P11089UniChem compound ID97603794

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