4-[(1R)-2-Amino-1-hydroxyethyl]-2-hydroxyphenyl hydrogen sulfate
[CAS# 77469-51-3]

Identification

• Name: 4-[(1R)-2-Amino-1-hydroxyethyl]-2-hydroxyphenyl hydrogen sulfate
• Synonyms: 1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, hydrogen sulfate (ester), (R)-; Noradrenaline sulfoconjugate; Norepinephrine-3-O-sulfate
• Molecular Formula: C₈H₁₁NO₆S
• Molecular Weight: 249.24
• CAS Registry Number: 77469-51-3
• SMILES: O=S(=O)(Oc1ccc(cc1O)[C@@H](O)CN)O
• InChI: 1S/C8H11NO6S/c9-4-7(11)5-1-2-8(6(10)3-5)15-16(12,13)14/h1-3,7,10-11H,4,9H2,(H,12,13,14)/t7-/m0/s1
• InChIKey: CVJMZWLHUCMEKO-ZETCQYMHSA-N

Properties

• Density: 1.677g/cm³ (Cal.)