Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C29H34O11
- Molecular weight
- 558.6 g/mol
- IUPAC name
- [(1R,3S,7R,9S,12R,14R,15S,17R,20Z,23Z)-28-hydroxy-10,16-dimethyl-4,19-dioxospiro[2,5,13,18,25-pentaoxahexacyclo[22.3.1.114,17.01,3.07,12.07,16]nonacosa-10,20,23-triene-15,2'-oxirane]-9-yl] acetate
- SMILES
- CC1=C[C@@H]2[C@@]3(C[C@@H]1OC(=O)C)COC(=O)[C@@H]4[C@@]5(O4)CCO/C(=C\C/C=C\C(=O)O[C@H]6C3([C@]7(CO7)[C@@H](C6)O2)C)/C5O
- InChIKey
- BDPRKFBFVAVFJK-YMQWBDTMSA-N
- XLogP
- 0.6
- Polar surface area
- 143 Ų
- H-bond donors
- 1
- H-bond acceptors
- 11
- Formal charge
- 0
via PubChem
Wikidata facts
- Subclass of
- chemical compound
- Mass
- 558.2101119079999
Show 3 more facts
- canonical SMILES
- CC(=O)OC1CC23COC(=O)C4OC45CCOC(=CCC=CC(=O)OC4CC(OC2C=C1C)C1(CO1)C43C)C5O
- chemical formula
- C₂₉H₃₄O₁₁
- isomeric SMILES
- CC1=C[C@]2([H])[C@]([C@@](C)3[C@]4(CO4)[C@@]([H])(C[C@H]3OC5=O)O2)(CO[C@]([C@@H](O7)[C@]([C@H]/6O)7CCOC6=C/C/C=C\5)=O)C[C@@H]1OC(C)=O
Sources (2)
via Wikidata · CC0