oxypaeoniflora

CAS: 39011-91-1

Formula: C23H28O12

SMILES: [H][C@@]12C[C@@]3(O[C@]4([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@]1(COC(=O)C1=CC=C(O)C=C1)[C@@]1([H])O[C@]2(O)C[C@]3(C)O1

IUPAC: [(1R,2S,3R,5R,6R,8S)-6-hydroxy-8-methyl-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl 4-hydroxybenzoate

InChI: InChI=1S/C23H28O12/c1-20-8-22(30)13-6-23(20,33-18-16(28)15(27)14(26)12(7-24)32-18)21(13,19(34-20)35-22)9-31-17(29)10-2-4-11(25)5-3-10/h2-5,12-16,18-19,24-28,30H,6-9H2,1H3/t12-,13-,14+,15-,16+,18+,19-,20+,21+,22-,23+/m0/s1

Composition: C (55.64%), H (5.68%), O (38.67%)

Molar Mass: 496.465

Atom Count: 63

Heavy Atom Count: 35