
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 115960-14-0 |
| Catalog No. | 2A-1183769 |
| Chinese Name | 羟基地奥司明 |
| Synonyms | F 117; Venosmil; Hidrosmin; I06-2483 |
| Molecular Formula | C30H36O16 |
| Molecular Weight | 652.59700 |
| Density | 1.63g/cm3 |
| Boiling Point | 962.7ºC at 760 mmHg |
| Water Solubility | Practically insoluble (0.044 g/L) (25 ºC) |
| PubChem ID | 9472850 |
| SMILES | COc1ccc(-c2cc(=O)c3c(OCCO)cc(OC4OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C4O)cc3o2)cc1O |
| InChI | InChI=1S/C30H36O16/c1-12-23(34)25(36)27(38)29(43-12)42-11-21-24(35)26(37)28(39)30(46-21)44-14-8-19(41-6-5-31)22-16(33)10-18(45-20(22)9-14)13-3-4-17(40-2)15(32)7-13/h3-4,7-10,12,21,23-32,34-39H,5-6,11H2,1-2H3/t12-,21+,23-,24+,25+,26-,27+,28+,29+,30+/m0/s1 |
| InChI Key | XYFLWVOTXWXNAM-WTNNCJBMSA-N |
| Transport Info | Product name: Bioflavonoid-d4 |
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