Showing Metabocard for (2R,3E)-phycocyanobilin (BASm0007312)
| Common Name | (2r,3e)-phycocyanobilin |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C33H36N4O6 |
| Average Mass | 584.67400 |
| Monoisotopic Mass | 584.26458 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | C/C=C1C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)C(CC)=C4C)c(C)c3CCC(=O)[O-])C(CCC(=O)[O-])=C2C)/NC(=O)[C@@H]/1C |
| InChI Identifier | InChI=1S/C33H38N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7,13-15,19,34H,8-12H2,1-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/p-2/b20-7-,26-13-,27-14-,29-15-/t19-/m1/s1 |
| InChI Key | XAVVMXGLKJSJDU-NSNBCYBJSA-L |
| CHEBI ID | CHEBI:85275 |
| MiMeDB ID | MMDBc0054815 |
| State | Expected Solid |
| 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 | Not Available |
| Polarizability | Not Available |