7-Cysteinyldehydroretronecine
[CAS# 64660-85-1]

Identification

• Name: 7-Cysteinyldehydroretronecine
• Synonyms: (2R)-2-Amino-3-[[(1R)-7-(Hydroxymethyl)-2,3-Dihydro-1H-Pyrrolizin-1-Yl]Thio]Propanoic Acid; (2R)-2-Amino-3-[[(1R)-7-Methylol-2,3-Dihydro-1H-Pyrrolizin-1-Yl]Thio]Propionic Acid; L-Cysteine, S-(2,3-Dihydro-7-(Hydroxymethyl)-1H-Pyrrolizin-1-Yl)-, (R)-
• Molecular Formula: C₁₁H₁₆N₂O₃S
• Molecular Weight: 256.32
• CAS Registry Number: 64660-85-1
• SMILES: [C@H]1(CC[N]2C1=C(C=C2)CO)SC[C@@H](C(=O)O)N
• InChI: 1S/C11H16N2O3S/c12-8(11(15)16)6-17-9-2-4-13-3-1-7(5-14)10(9)13/h1,3,8-9,14H,2,4-6,12H2,(H,15,16)/t8-,9+/m0/s1
• InChIKey: SQSGSRJUBPDLGK-DTWKUNHWSA-N

Properties

• Density: 1.538g/cm³ (Cal.)
• Boiling point: 519.956°C at 760 mmHg (Cal.)
• Flash point: 268.26°C (Cal.)