114390-31-7
114390-31-7 structure
- Name: aconityldoxorubicin
- Chemical Name: (2Z)-2-[2-[[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]amino]-2-oxoethylidene]butanedioic acid
- CAS Number: 114390-31-7
- Molecular Formula: C33H33NO16
- Molecular Weight: 699.61200
- Create Date: 2016-12-31 01:57:42
- Modify Date: 2024-01-07 01:41:04
| Name | (2Z)-2-[2-[[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]amino]-2-oxoethylidene]butanedioic acid |
|---|---|
| Synonyms |
CA-Dxr
Aconityldoxorubicin cis-aconityl-doxorubicin |
| Density | 1.68g/cm3 |
|---|---|
| Boiling Point | 1062.7ºC at 760mmHg |
| Molecular Formula | C33H33NO16 |
| Molecular Weight | 699.61200 |
| Flash Point | 596.5ºC |
| Exact Mass | 699.18000 |
| PSA | 287.24000 |
| LogP | 0.48480 |
| Vapour Pressure | 0mmHg at 25°C |
| Index of Refraction | 1.712 |
| Precursor 3 | |
|---|---|
| DownStream 0 | |