3-Butynoylpantetheine
[CAS# 29315-43-3]

Identification

• Name: 3-Butynoylpantetheine
• Synonyms: S-[2-[3-[(2,4-Dihydroxy-3,3-Dimethyl-Butanoyl)Amino]Propanoylamino]Ethyl] But-2-Ynethioate; But-2-Ynethioic Acid S-[2-[[3-[(2,4-Dihydroxy-3,3-Dimethyl-1-Oxobutyl)Amino]-1-Oxopropyl]Amino]Ethyl] Ester; But-2-Ynethioic Acid S-[2-[3-[(2,4-Dihydroxy-3,3-Dimethyl-Butanoyl)Amino]Propanoylamino]Ethyl] Ester
• Molecular Formula: C₁₅H₂₄N₂O₅S
• Molecular Weight: 344.43
• CAS Registry Number: 29315-43-3
• SMILES: C(O)C(C(O)C(=O)NCCC(=O)NCCSC(=O)C#CC)(C)C
• InChI: 1S/C15H24N2O5S/c1-4-5-12(20)23-9-8-16-11(19)6-7-17-14(22)13(21)15(2,3)10-18/h13,18,21H,6-10H2,1-3H3,(H,16,19)(H,17,22)
• InChIKey: YKAMKQGIIXZWEY-UHFFFAOYSA-N