3-Pentynoylpantetheine
[CAS# 50304-43-3]

Identification

• Name: 3-Pentynoylpantetheine
• Synonyms: S-[2-[3-[[(2R)-2,4-Dihydroxy-3,3-Dimethyl-Butanoyl]Amino]Propanoylamino]Ethyl] Pent-3-Ynethioate; Pent-3-Ynethioic Acid S-[2-[[3-[[(2R)-2,4-Dihydroxy-3,3-Dimethyl-1-Oxobutyl]Amino]-1-Oxopropyl]Amino]Ethyl] Ester; Pent-3-Ynethioic Acid S-[2-[3-[[(2R)-2,4-Dihydroxy-3,3-Dimethyl-Butanoyl]Amino]Propanoylamino]Ethyl] Ester
• Molecular Formula: C₁₆H₂₆N₂O₅S
• Molecular Weight: 358.45
• CAS Registry Number: 50304-43-3
• SMILES: [C@@H](O)(C(CO)(C)C)C(=O)NCCC(=O)NCCSC(=O)CC#CC
• InChI: 1S/C16H26N2O5S/c1-4-5-6-13(21)24-10-9-17-12(20)7-8-18-15(23)14(22)16(2,3)11-19/h14,19,22H,6-11H2,1-3H3,(H,17,20)(H,18,23)/t14-/m0/s1
• InChIKey: PDDLZJQBTTUWOI-AWEZNQCLSA-N