OXYPEUCEDANIN HYDRATE (P) structure
|
Common Name | OXYPEUCEDANIN HYDRATE (P) | ||
|---|---|---|---|---|
| CAS Number | 384329-61-7 | Molecular Weight | 879.08100 | |
| Density | 1.25g/cm3 | Boiling Point | 882.7ºC at 760 mmHg | |
| Molecular Formula | C47H74O15 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 248.4ºC | |
| Name | P57 (glycoside) |
|---|---|
| Synonym | More Synonyms |
| Density | 1.25g/cm3 |
|---|---|
| Boiling Point | 882.7ºC at 760 mmHg |
| Molecular Formula | C47H74O15 |
| Molecular Weight | 879.08100 |
| Flash Point | 248.4ºC |
| Exact Mass | 878.50300 |
| PSA | 187.13000 |
| LogP | 6.24 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.557 |
| InChIKey | CBMQKMMZBOSHHP-VXXSQTRDSA-N |
| SMILES | CC=C(C)C(=O)OC1CC2C(CC=C3CC(OC4CC(OC)C(OC5CC(OC)C(OC6OC(C)C(O)C(OC)C6O)C(C)O5)C(C)O4)CCC32C)C2(O)CCC(C(C)=O)C12C |
| (3β,12β,14β)-3-{[6-Deoxy-3-O-methyl-β-D-glucopyranosyl-(1->4)-2,6-dideoxy-3-O-methyl-β-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-3-O-methyl-β-D-ribo-hexopyranosyl]oxy}-14-hydroxy-20-ox
 opregn-5-en-12-yl (2E)-2-methyl-2-butenoate |
| 2-Butenoic acid, 2-methyl-, (3β,12β,14β)-3-[[O-6-deoxy-3-O-methyl-β-D-glucopyranosyl-(1->4)-O-2,6-dideoxy-3-O-methyl-β-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-3-O-methyl-β-D-ribo-hex
 opyranosyl]oxy]-14-hydroxy-20-oxopregn-5-en-12-yl ester, (2E)- |
| P57 |
| 17-acetyl-3-((5-((5-((3,5-dihydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-14-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-12-yl (Z)-2-methylbut-2-enoate |
| P57AS3 |
| P57 (glycoside) |