Produkty 18913-60-5
CAS 18913-60-5 to numer rejestracyjny substancji Neochebulinic acid, ≥98%. Oferty producentów: Chemat. Dostępne opakowania: 5mg.
4-[3-carboxy-1-[5-hydroxy-4,6-bis[(3,4,5-trihydroxybenzoyl)oxy]-2-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxan-3-yl]oxy-1-oxopropan-2-yl]-5,6,7-trihydroxy-1-oxo-3,4-dihydroisochromene-3-carboxylic acid (CAS 18913-60-5) to związek chemiczny o wzorze sumarycznym C41H34O28 i masie molowej 974.7 g/mol. Nazwa systematyczna IUPAC: 4-[3-carboxy-1-[5-hydroxy-4,6-bis[(3,4,5-trihydroxybenzoyl)oxy]-2-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxan-3-yl]oxy-1-oxopropan-2-yl]-5,6,7-trihydroxy-1-oxo-3,4-dihydroisochromene-3-carboxylic acid. InChIKey: LMHADULVMWIGNJ-UHFFFAOYSA-N.
| Wzór sumaryczny | C41H34O28 |
|---|---|
| Masa molowa | 974.7 g/mol |
| Nazwa IUPAC | 4-[3-carboxy-1-[5-hydroxy-4,6-bis[(3,4,5-trihydroxybenzoyl)oxy]-2-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxan-3-yl]oxy-1-oxopropan-2-yl]-5,6,7-trihydroxy-1-oxo-3,4-dihydroisochromene-3-carboxylic acid |
| InChIKey | LMHADULVMWIGNJ-UHFFFAOYSA-N |
| SMILES | C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C(CC(=O)O)C5C(OC(=O)C6=CC(=C(C(=C56)O)O)O)C(=O)O |
Dane obliczone przez PubChem (NCBI)