Showing Metabocard for N(5)-formyl-5,6,7,8-tetrahydromethanopterin (BASm0003138)
| Common Name | N(5)-formyl-5,6,7,8-tetrahydromethanopterin |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C31H42N6O17P |
| Average Mass | 801.67700 |
| Monoisotopic Mass | 801.23605 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | C[C@@H]1Nc2nc(N)[nH]c(=O)c2N(C=O)C1[C@@H](C)Nc1ccc(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]2O[C@H](COP(=O)([O-])O[C@@H](CCC(=O)[O-])C(=O)[O-])[C@@H](O)[C@H]2O)cc1 |
| InChI Identifier | InChI=1S/C31H45N6O17P/c1-13(22-14(2)34-27-23(37(22)12-38)28(46)36-31(32)35-27)33-16-5-3-15(4-6-16)9-17(39)24(43)18(40)10-51-30-26(45)25(44)20(53-30)11-52-55(49,50)54-19(29(47)48)7-8-21(41)42/h3-6,12-14,17-20,22,24-26,30,33,39-40,43-45H,7-11H2,1-2H3,(H,41,42)(H,47,48)(H,49,50)(H4,32,34,35,36,46)/p-3/t13-,14+,17+,18-,19+,20-,22?,24+,25-,26-,30+/m1/s1 |
| InChI Key | RMPHWTMYCVTPKB-QZQIFXBMSA-K |
| CHEBI ID | CHEBI:58018 |
| MiMeDB ID | MMDBc0048042 |
| 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 |