(6R)-2-Amino-6-[(2S)-2-hydroxypropanoyl]-5,6,7,8-tetrahydro-4(1H)-pteridinone
[CAS# 87622-51-3]

Identification

• Name: (6R)-2-Amino-6-[(2S)-2-hydroxypropanoyl]-5,6,7,8-tetrahydro-4(1H)-pteridinone
• Synonyms: 1-Propanone, 1-(2-amino-5,6,7,8-tetrahydro-4-hydroxy-6-pteridinyl)-2-hydroxy-, (S-(R*,S*))-; Tetrahydrosepiapterin
• Molecular Formula: C₉H₁₃N₅O₃
• Molecular Weight: 239.23
• CAS Registry Number: 87622-51-3
• SMILES: O=C([C@@H]2N/C1=C(/N/C(=N\C1=O)N)NC2)[C@@H](O)C
• InChI: 1S/C9H13N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h3-4,12,15H,2H2,1H3,(H4,10,11,13,14,17)/t3-,4+/m0/s1
• InChIKey: HKCYZTKHPLJZDR-IUYQGCFVSA-N

Properties

• Density: 1.882g/cm³ (Cal.)
• Boiling point: 478.317°C at 760 mmHg (Cal.)
• Flash point: 243.078°C (Cal.)