ZZZ
Summary
Name: | 6-FORMYLTETRAHYDROPTERIN |
Synonyms: | (6S)-2-AMINO-4-OXO-3,4,5,6,7,8-HEXAHYDROPTERIDINE-6-CARBALDEHYDE |
Formula: | C7 H9 N5 O2 |
Formal charge: | 0 |
Formula weight: | 195.179 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (6R)-2-amino-4-oxo-3,4,5,6,7,8-hexahydropteridine-6-carbaldehyde |
OpenEye OEToolkits | 1.5.0 | (6R)-2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pteridine-6-carbaldehyde |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=CC1NC=2C(=O)NC(=NC=2NC1)N |
SMILES_CANONICAL | CACTVS | 3.341 | NC1=NC2=C(N[C@H](CN2)C=O)C(=O)N1 |
SMILES | CACTVS | 3.341 | NC1=NC2=C(N[CH](CN2)C=O)C(=O)N1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1[C@@H](NC2=C(N1)N=C(NC2=O)N)C=O |
SMILES | OpenEye OEToolkits | 1.5.0 | C1C(NC2=C(N1)N=C(NC2=O)N)C=O |
InChI | InChI | 1.03 | InChI=1S/C7H9N5O2/c8-7-11-5-4(6(14)12-7)10-3(2-13)1-9-5/h2-3,10H,1H2,(H4,8,9,11,12,14)/t3-/m1/s1 |
InChIKey | InChI | 1.03 | LBARDZPDAYELSB-GSVOUGTGSA-N |