CAS 532387-86-3: Esculeoside A

Formula: C₅₈H₉₅NO₂₉

InChI: InChI=1S/C58H95NO29/c1-21-36-30(88-58(21)35(79-22(2)64)11-23(14-59-58)19-77-51-45(74)41(70)38(67)31(15-60)81-51)13-28-26-6-5-24-12-25(7-9-56(24,3)27(26)8-10-57(28,36)4)80-53-47(76)43(72)48(34(18-63)84-53)85-55-50(87-54-46(75)42(71)39(68)32(16-61)82-54)49(40(69)33(17-62)83-55)86-52-44(73)37(66)29(65)20-78-52/h21,23-55,59-63,65-76H,5-20H2,1-4H3/t21-,23-,24-,25-,26+,27-,28-,29+,30-,31+,32+,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43+,44+,45+,46+,47+,48-,49-,50+,51+,52-,53+,54-,55-,56-,57-,58-/m0/s1

InChI key: InChIKey=VSQBWNYALURFOT-ZSFCQSFNSA-N

SMILES: O=C(OC1CC(COC2OC(CO)C(O)C(O)C2O)CNC31OC4CC5C6CCC7CC(OC8OC(CO)C(OC9OC(CO)C(O)C(OC%10OCC(O)C(O)C%10O)C9OC%11OC(CO)C(O)C(O)C%11O)C(O)C8O)CCC7(C)C6CCC5(C)C4C3C)C

Synonyms:

• 3-O-β-lycotetraosyl (5S,22S,23S,25S)-23-acetoxy-3β,27-dihydroxyspirosolane 27-O-β-D-glucopyranoside
• Esculeoside A
• (3β,5α,22α,23S,25S)-23-(Acetyloxy)-27-(β-D-glucopyranosyloxy)spirosolan-3-yl O-β-D-glucopyranosyl-(1→2)-O-[β-D-xylopyranosyl-(1→3)]-O-β-D-glucopyranosyl-(1→4)-β-D-galactopyranoside
• β-D-Galactopyranoside, (3β,5α,22α,23S,25S)-23-(acetyloxy)-27-(β-D-glucopyranosyloxy)spirosolan-3-yl O-β-D-glucopyranosyl-(1→2)-O-[β-D-xylopyranosyl-(1→3)]-O-β-D-glucopyranosyl-(1→4)-

Esculeoside A

CAS: 532387-86-3

• Formula: C₅₈H₉₅NO₂₉
• Molecular weight: 1270.38

Esculeoside A

CAS: 532387-86-3

Spirosolane-type steroidal alkaloid glycoside found in ripe cherry tomato

• Formula: C₅₈H₉₅NO₂₉
• Purity: Min. 95%
• Color and Shape: Powder
• Molecular weight: 1,270.37 g/mol