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ACUTANGULOSIDE-E;3-O-BETA-D-XYLOPYRANOSYL-(1->3)-[BETA-D-GALACTOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSYL-21-O-BENZOYL-22-O-TIGLOYL-BARRINGT
SpectraBase Compound ID Jt39L7SC4P1
InChI InChI=1S/C59H86O22/c1-10-27(2)49(72)81-47-46(80-50(73)28-14-12-11-13-15-28)54(3,4)22-30-29-16-17-34-56(7)20-19-36(55(5,6)33(56)18-21-57(34,8)58(29,9)23-35(63)59(30,47)26-61)76-53-45(79-52-41(68)39(66)38(65)32(24-60)75-52)43(42(69)44(78-53)48(70)71)77-51-40(67)37(64)31(62)25-74-51/h10-16,30-47,51-53,60-69H,17-26H2,1-9H3,(H,70,71)/b27-10-/t30-,31-,32+,33-,34?,35+,36-,37+,38-,39-,40-,41+,42+,43+,44+,45-,46-,47-,51+,52-,53-,56-,57+,58+,59-/m0/s1
InChIKey PQWRZZBQEIVFHI-SFSPPZCGSA-N
Mol Weight 1147.3 g/mol
Molecular Formula C59H86O22
Exact Mass 1146.561074 g/mol
Enantiomer InChIKey PQWRZZBQEIVFHI-UGSNAYTOSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Title Journal or Book Year
Acutangulosides A−F, Monodesmosidic Saponins from the Bark of Barringtonia acutangula Journal of Natural Products 2005
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