$96.00
| CAS No.: | 72520-92-4 |
| Molecular Formula | C₂₀H₂₈O₁₂ |
| Molecular Weight | 460.4g/mol |
| Purity | HPLC>98% |
| Chemical Family | Phenols |
| Weight |
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* Warning: BIORLAB’s Natural Compounds are for laboratory research purposes only.
IUPAC Name: 1-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]ethanone
InChI: InChI=1S/C20H28O12/c1-8(21)10-4-3-9(28-2)5-12(10)31-20-18(27)16(25)15(24)13(32-20)7-30-19-17(26)14(23)11(22)6-29-19/h3-5,11,13-20,22-27H,6-7H2,1-2H3/t11-,13+,14-,15+,16-,17+,18+,19-,20+/m0/s1
InChIKey: IDZZECHGWAZTIB-NYBIBFQCSA-N
Canonical SMILES: CC(=O)C1=C(C=C(C=C1)OC)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)O)O)O
Isomeric SMILES: CC(=O)C1=C(C=C(C=C1)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@H](CO3)O)O)O)O)O)O
Synonyms: Paeonolide; 72520-92-4; C10715; CHEMBL1080061; CHEBI:7891; 1-[4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyphenyl]ethanone; AC1L9DNN; DTXSID20993369; …
Botanical Source: Paeonia suffruticosa Andr.
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