Showing Metabocard for 2alpha,7beta-dihydroxytaxusin (BASm0012052)
| Common Name | 2alpha,7beta-dihydroxytaxusin |
|---|---|
| Description | A taxane diterpenoid that is taxusin substituted by hydroxy groups at positions 2alpha and 7beta. |
| Structure | |
| Molecular Formula | C28H40O10 |
| Average Mass | 536.61800 |
| Monoisotopic Mass | Not Available |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | C=C1[C@@H](OC(C)=O)C[C@H](O)[C@@]2(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C3=C(C)[C@@H](OC(C)=O)C[C@@H]([C@@H](O)[C@H]12)C3(C)C |
| InChI Identifier | InChI=1S/C28H40O10/c1-12-20(36-15(4)30)11-21(33)28(9)22(12)24(34)18-10-19(35-14(3)29)13(2)23(27(18,7)8)25(37-16(5)31)26(28)38-17(6)32/h18-22,24-26,33-34H,1,10-11H2,2-9H3/t18-,19-,20-,21-,22-,24+,25+,26-,28+/m0/s1 |
| InChI Key | VWTJGLYGEBYALH-LNLYLEBQSA-N |
| CHEBI ID | CHEBI:190506 |
| State | Not Available |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | 0 |
| Polarizability | Not Available |