Thiosangivamycin
[CAS# 22242-90-6]

Identification

• Name: Thiosangivamycin
• Synonyms: 4-Amino-7-[3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Pyrrolo[5,4-D]Pyrimidine-5-Carbothioamide; 4-Amino-7-[3,4-Dihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-5-Pyrrolo[5,4-D]Pyrimidinecarbothioamide; 4-Amino-7-(3,4-Dihydroxy-5-Methylol-Tetrahydrofuran-2-Yl)Pyrrolo[5,4-D]Pyrimidine-5-Carbothioamide
• Molecular Formula: C₁₂H₁₅N₅O₄S
• Molecular Weight: 325.34
• CAS Registry Number: 22242-90-6
• SMILES: C1=C(C(=S)N)C3=C([N]1C2C(C(O)C(O2)CO)O)N=CN=C3N
• InChI: 1S/C12H15N5O4S/c13-9-6-4(10(14)22)1-17(11(6)16-3-15-9)12-8(20)7(19)5(2-18)21-12/h1,3,5,7-8,12,18-20H,2H2,(H2,14,22)(H2,13,15,16)
• InChIKey: XZOKDXWQSCIKCM-UHFFFAOYSA-N

Properties

• Density: 2.02g/cm³ (Cal.)
• Boiling point: 746.441°C at 760 mmHg (Cal.)
• Flash point: 405.233°C (Cal.)