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ACUTANGULOSIDE-C;3-O-BETA-D-XYLOPYRANOSYL-(1->3)-[BETA-D-GALACTOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSYL-21-O-BENZOYL-BARRINGTOGENOL-C
SpectraBase Compound ID 8w0X4Js9rap
InChI InChI=1S/C54H80O21/c1-49(2)19-26-25-13-14-30-51(5)17-16-32(50(3,4)29(51)15-18-52(30,6)53(25,7)20-31(58)54(26,23-56)42(65)43(49)75-45(68)24-11-9-8-10-12-24)71-48-41(74-47-37(63)35(61)34(60)28(21-55)70-47)39(38(64)40(73-48)44(66)67)72-46-36(62)33(59)27(57)22-69-46/h8-13,26-43,46-48,55-65H,14-23H2,1-7H3,(H,66,67)/t26-,27-,28+,29-,30?,31+,32-,33+,34-,35-,36-,37+,38+,39+,40+,41-,42-,43-,46+,47-,48-,51-,52+,53+,54-/m0/s1
InChIKey BVLILAASBFCECD-MZYDHQHJSA-N
Mol Weight 1065.2 g/mol
Molecular Formula C54H80O21
Exact Mass 1064.51921 g/mol
Enantiomer InChIKey BVLILAASBFCECD-MXVHRRAQSA-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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