Products 287101-82-0
CAS 287101-82-0 is the registry number for Vaticanol A. Offered by: MedChemExpress. Available pack sizes: Get quote.
(1S,2S,3S,9R,10R,17R)-3-(3,5-dihydroxyphenyl)-2,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol (CAS 287101-82-0) is a chemical compound with the molecular formula C42H32O9 and a molecular weight of 680.7 g/mol. IUPAC name: (1S,2S,3S,9R,10R,17R)-3-(3,5-dihydroxyphenyl)-2,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol. InChIKey: MBGBQHRAJPLAPN-WTEBWGKASA-N.
| Molecular formula | C42H32O9 |
|---|---|
| Molecular weight | 680.7 g/mol |
| IUPAC name | (1S,2S,3S,9R,10R,17R)-3-(3,5-dihydroxyphenyl)-2,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.04,18.07,19.011,16]nonadeca-4(18),5,7(19),11(16),12,14-hexaene-5,13,15-triol |
| InChIKey | MBGBQHRAJPLAPN-WTEBWGKASA-N |
| SMILES | C1=CC(=CC=C1[C@H]2[C@H]3[C@@H](C4=C(C=C(C=C4O)O)[C@H]5[C@@H](OC6=C5C3=C([C@@H]2C7=CC(=CC(=C7)O)O)C(=C6)O)C8=CC=C(C=C8)O)C9=CC=C(C=C9)O)O |
Computed by PubChem (NCBI)
Synonyms:
vaticanol A, orb3179833