C41H43NO10.ClH
7-[4-(dibenzylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(1-hydroxyethyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride
Also Known As: C41-H43-N-O10.Cl-H.3/2H2-O|N,N-Dibenzyl-13-dihydrodaunorubicin hydrochloride hydrate|5,12-Naphthacenedione, 7,8,9,10-tetrahydro-10-((3-(bis(phenylmethyl)amino)-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-8-(1-hydroxyethyl)-1-methoxy-6,8,11-trihydroxy-, hydrochloride, hydrate, (8S-cis)- (2:2:3)|5,12-Naphthacenedione, 10-[[3-[bis(phenylmethyl)amino]-2,3,6|7-[4-(dibenzylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(1-hydroxyethyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
| Molecular Formula | C41H44ClNO10 |
|---|---|
| Molecular Weight | 745.2654 g/mol |
| LogP | 4.9862 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 745.2654 |
| Monoisotopic Mass | 745.2654 |
| Heavy Atoms | 53 |
| Complexity | 1220.0 |
Chemical Identifiers
| CAS Number | 70844-06-3 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(C)O)O)N(CC6=CC=CC=C6)CC7=CC=CC=C7)O.Cl |
| InChIKey | OFIFBABFTAUYNZ-UHFFFAOYSA-N |
Product Overview
C41H43NO10.ClH (CAS 70844-06-3), with molecular formula C41H44ClNO10 and molecular weight 745.2654 g/mol. IUPAC: 7-[4-(dibenzylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(1-hydroxyethyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride.