14-Morpholinodaunorubicin
7-[(2S,5S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-9-(2-morpholin-4-ylacetyl)-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: 14-Morpholinodaunorubicin|5,12-Naphthacenedione, 7,8,9,10-tetrahydro-10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-1-methoxy-8-(4-morpholinylacetyl)-6,8,11-trihydroxy-, (8S-cis)-|3,5,12-trihydroxy-10-methoxy-3-(morpholin-4-ylacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-|A-d-glycero-hexopyranoside|3,5,12-Trihydroxy-10-methoxy-3-[(morpholin-4-yl)acetyl]-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-D-glycero-hexopyranoside|3,5,12-Trihydroxy-10-methoxy-3-[(morpholin-4-yl)acetyl]-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside|7-[(2S,5S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-9-(2-morpholin-4-ylacetyl)-8,10-dihydro-7H-tetracene-5,12-dione
| Molecular Formula | C31H36N2O11 |
|---|---|
| Molecular Weight | 612.23193 g/mol |
| LogP | 0.34 |
| Topological Polar Surface Area | 198.31 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 612.23193 |
| Heavy Atoms | 44 |
| Complexity | 1508.7 |
Chemical Identifiers
| CAS Number | 76549-16-1 |
|---|---|
| SMILES | CC1[C@H](C(C[C@H](O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CN6CCOCC6)O)N)O |
Product Overview
14-Morpholinodaunorubicin (CAS 76549-16-1), with molecular formula C31H36N2O11 and molecular weight 612.23193 g/mol. IUPAC: 7-[(2S,5S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-9-(2-morpholin-4-ylacetyl)-8,10-dihydro-7H-tetracene-5,12-dione.
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