SpectraBase Compound ID | ER34Opn12fJ |
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InChI | InChI=1S/C52H84O20/c1-23-32(55)40(71-42-37(60)33(56)26(54)21-65-42)39(62)44(67-23)72-41-35(58)28(69-43-38(61)36(59)34(57)27(20-53)68-43)22-66-45(41)70-31-12-13-49(6)29(48(31,4)5)11-14-51(8)30(49)10-9-24-25-19-47(2,3)15-17-52(25,46(63)64)18-16-50(24,51)7/h9,23,25-45,53-62H,10-22H2,1-8H3,(H,63,64)/t23-,25-,26+,27+,28-,29-,30+,31-,32-,33-,34+,35-,36-,37+,38+,39+,40+,41+,42-,43-,44-,45-,49-,50+,51+,52-/m0/s1 |
InChIKey | YMUVECXYJPPWBW-ZQPXAOBSSA-N |
Mol Weight | 1029.2 g/mol |
Molecular Formula | C52H84O20 |
Exact Mass | 1028.555595 g/mol |
SpectraBase Spectrum ID | 2wajGKA267a |
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Name | 3-BETA-O-[BETA-D-XYLOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->4)]-ALPA-L-ARABINOPYRANOSYL]-OLEANOLIC-ACID |
Compound Number | 8 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C52H84O20 |
InChI | InChI=1S/C52H84O20/c1-23-32(55)40(71-42-37(60)33(56)26(54)21-65-42)39(62)44(67-23)72-41-35(58)28(69-43-38(61)36(59)34(57)27(20-53)68-43)22-66-45(41)70-31-12-13-49(6)29(48(31,4)5)11-14-51(8)30(49)10-9-24-25-19-47(2,3)15-17-52(25,46(63)64)18-16-50(24,51)7/h9,23,25-45,53-62H,10-22H2,1-8H3,(H,63,64)/t23-,25-,26+,27+,28-,29-,30+,31-,32-,33-,34+,35-,36-,37+,38+,39+,40+,41+,42-,43-,44-,45-,49-,50+,51+,52-/m0/s1 |
InChIKey | YMUVECXYJPPWBW-ZQPXAOBSSA-N |
Literature Reference Author | X.WANG,M.WANG,M.XU,Y.WANG,H.TANG,X.SUN |
Literature Reference Citation | MOLECULES,19,2121(2014) |
Literature Reference DOI | 10.3390/molecules19022121 |
Molecular Weight | 1029.227 g/mol |
Solvent | C5D5N |
Source File Reference | UWBT14591 |