|
2OM : Summary
Code
|
2OM
|
One-letter code
|
U
|
Molecule name
|
5,6-dihydroorotidine 5'-monophosphate
|
Systematic names
|
|
Formula
|
C10 H15 N2 O11 P
|
Formal charge
|
0
|
Molecular weight
|
370.207 Da
|
SMILES
|
Type | Program | Version | Descriptor |
SMILES
|
ACDLabs |
10.04 |
O=C(O)C1N(C(=O)NC(=O)C1)C2OC(C(O)C2O)COP(=O)(O)O |
SMILES
|
CACTVS |
3.341 |
O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(O)=O)N2[CH](CC(=O)NC2=O)C(O)=O |
SMILES
|
OpenEye OEToolkits |
1.5.0 |
C1C(N(C(=O)NC1=O)C2C(C(C(O2)COP(=O)(O)O)O)O)C(=O)O |
Canonical SMILES
|
CACTVS |
3.341 |
O[C@H]1[C@@H](O)[C@@H](O[C@@H]1CO[P](O)(O)=O)N2[C@H](CC(=O)NC2=O)C(O)=O |
Canonical SMILES
|
OpenEye OEToolkits |
1.5.0 |
C1[C@@H](N(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O)C(=O)O |
|
IUPAC InChI | InChI=1S/C10H15N2O11P/c13-5-1-3(9(16)17)12(10(18)11-5)8-7(15)6(14)4(23-8)2-22-24(19,20)21/h3-4,6-8,14-15H,1-2H2,(H,16,17)(H,11,13,18)(H2,19,20,21)/t3-,4-,6-,7-,8-/m1/s1 |
IUPAC InChI key | ZVESSEXVBFSYOC-NFTAXOAUSA-N |
|
wwPDB Information |
Atom count
|
39 (24 without Hydrogen)
|
Polymer type
|
Ribonucleotide
|
Type description
|
RNA LINKING
|
Type code
|
ATOMN
|
Is modified
|
Yes
|
Standard parent
|
U
|
Defined at
|
2009-02-06
|
Last modified at
|
2011-06-04
|
Status
|
Released
|
Obsoleted
|
Not Assigned
|
|