Products 881013-34-9

CAS 881013-34-9 is the registry number for Davidiol A. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

(1R,2S,3S,9S,10S,17S)-2-(3,5-dihydroxyphenyl)-3,9,17-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 881013-34-9) is a chemical compound with the molecular formula C42H32O9 and a molecular weight of 680.7 g/mol. IUPAC name: (1R,2S,3S,9S,10S,17S)-2-(3,5-dihydroxyphenyl)-3,9,17-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: QDEHKEFWCRAFDN-HOWWATCWSA-N.

Identity
Molecular formulaC42H32O9
Molecular weight680.7 g/mol
IUPAC name(1R,2S,3S,9S,10S,17S)-2-(3,5-dihydroxyphenyl)-3,9,17-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
InChIKeyQDEHKEFWCRAFDN-HOWWATCWSA-N
SMILESC1=CC(=CC=C1[C@@H]2[C@H]([C@@H]3[C@H](C4=C(C=C(C=C4O)O)[C@@H]5[C@H](OC6=C5C3=C2C(=C6)O)C7=CC=C(C=C7)O)C8=CC=C(C=C8)O)C9=CC(=CC(=C9)O)O)O

Computed by PubChem (NCBI)

Synonyms: Davidiol A, orb3179932