1,3-Dihexadecanoyl-2-(2-Amino-3-(3,4-Dihydroxyphenyl)Propanoyl)Propane-1,2,3-Triol
[CAS# 100858-16-0]

Identification

• Name: 1,3-Dihexadecanoyl-2-(2-Amino-3-(3,4-Dihydroxyphenyl)Propanoyl)Propane-1,2,3-Triol
• Synonyms: 18-[2-Amino-3-(2,3-Dihydroxyphenyl)Propanoyl]-17,18,19-Trihydroxy-Pentatriacontane-16,20-Dione; 18-[2-Amino-3-(2,3-Dihydroxyphenyl)-1-Oxopropyl]-17,18,19-Trihydroxypentatriacontane-16,20-Dione; 1,3-Dihexadecanoyl-2-(2-Amino-3-(3,4-Dihydroxyphenyl)Propanoyl)Propane-1,2,3-Triol
• Molecular Formula: C₄₄H₇₇NO₈
• Molecular Weight: 748.09
• CAS Registry Number: 100858-16-0
• SMILES: C1=C(CC(N)C(=O)C(O)(C(O)C(=O)CCCCCCCCCCCCCCC)C(O)C(=O)CCCCCCCCCCCCCCC)C(=C(O)C=C1)O
• InChI: 1S/C44H77NO8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-38(47)42(51)44(53,41(50)36(45)34-35-30-29-33-37(46)40(35)49)43(52)39(48)32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-30,33,36,42-43,46,49,51-53H,3-28,31-32,34,45H2,1-2H3
• InChIKey: NEPLGLCILRJJRU-UHFFFAOYSA-N