CAS: 55466-04-1 - Jujuboside A
Formula:C58H94O26
InChI:InChI=1S/C58H94O26/c1-23(2)15-25-16-56(8,72)47-26-9-10-32-54(6)13-12-33(53(4,5)31(54)11-14-55(32,7)57(26)21-58(47,84-25)76-22-57)80-51-46(83-50-43(71)38(66)34(62)24(3)77-50)44(28(61)19-74-51)81-52-45(82-49-41(69)35(63)27(60)18-73-49)40(68)37(65)30(79-52)20-75-48-42(70)39(67)36(64)29(17-59)78-48/h15,24-52,59-72H,9-14,16-22H2,1-8H3/t24-,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-,54-,55+,56-,57-,58-/m0/s1
InChI key:InChIKey=KVKRFLVYJLIZFD-OQVAHBRNSA-N
SMILES:OCC1OC(OCC2OC(OC3C(O)COC(OC4CCC5(C)C(CCC6(C)C5CCC7C8C(O)(C)CC(OC98OCC76C9)C=C(C)C)C4(C)C)C3OC%10OC(C)C(O)C(O)C%10O)C(OC%11OCC(O)C(O)C%11O)C(O)C2O)C(O)C(O)C1O
- Synonyms:
- (3beta,14xi,16beta,23R)-20-hydroxy-16,23:16,30-diepoxydammar-24-en-3-yl 6-deoxy-alpha-L-mannopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->6)-[beta-D-xylopyranosyl-(1->2)]-beta-D-glucopyranosyl-(1->3)]-L-arabinopyranoside
- (3β,16β,23R)-16,23:16,30-Diepoxy-20-hydroxydammar-24-en-3-yl O-6-deoxy-α-<span class="text-smallcaps">L</smallcap>-mannopyranosyl-(1→2)-O-[O-β-<smallcap>D</smallcap>-glucopyranosyl-(1→6)-O-[β-<smallcap>D</smallcap>-xylopyranosyl-(1→2)]-β-<smallcap>D</smallcap>-glucopyranosyl-(1→3)]-α-<smallcap>L</span>-arabinopyranoside
- α-<span class="text-smallcaps">L</smallcap>-Arabinopyranoside, (3β,16β,23R)-16,23:16,30-diepoxy-20-hydroxydammar-24-en-3-yl O-6-deoxy-α-<smallcap>L</smallcap>-mannopyranosyl-(1→2)-O-[O-β-<smallcap>D</smallcap>-glucopyranosyl-(1→6)-O-[β-<smallcap>D</smallcap>-xylopyranosyl-(1→2)]-β-<smallcap>D</span>-glucopyranosyl-(1→3)]-