Products 130756-25-1

CAS 130756-25-1 is the registry number for Tubuloside E, ≥90%, ≥90%. Offered by: Chemat. Available pack sizes: 5mg.

Structural formula: {0} (CAS {1})

[(2R,3R,4S,5R,6R)-5-acetyloxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate (CAS 130756-25-1) is a chemical compound with the molecular formula C31H38O15 and a molecular weight of 650.6 g/mol. IUPAC name: [(2R,3R,4S,5R,6R)-5-acetyloxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate. InChIKey: XWAGWSCLKIGRPW-RHHHWDBBSA-N.

Identity
Molecular formulaC31H38O15
Molecular weight650.6 g/mol
IUPAC name[(2R,3R,4S,5R,6R)-5-acetyloxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
InChIKeyXWAGWSCLKIGRPW-RHHHWDBBSA-N
SMILESC[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H](O[C@H]([C@@H]2OC(=O)C)OCCC3=CC(=C(C=C3)O)O)CO)OC(=O)/C=C/C4=CC=C(C=C4)O)O)O)O

Computed by PubChem (NCBI)