SpectraBase Compound ID | 5ypVHCFb8AT |
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InChI | InChI=1S/C54H86O23/c1-49(2)15-17-54(48(68)77-46-38(65)35(62)33(60)27(21-56)72-46)18-16-52(6)23(24(54)19-49)9-10-29-51(5)13-12-30(50(3,4)28(51)11-14-53(29,52)7)73-47-42(76-44-36(63)31(58)25(57)22-70-44)40(39(66)41(75-47)43(67)69-8)74-45-37(64)34(61)32(59)26(20-55)71-45/h9,24-42,44-47,55-66H,10-22H2,1-8H3/t24-,25+,26+,27+,28-,29+,30-,31-,32-,33+,34-,35-,36+,37+,38+,39-,40-,41-,42+,44-,45-,46-,47+,51-,52+,53+,54-/m0/s1 |
InChIKey | GDOPGDHWLRJHTG-BPWXWGEJSA-N |
Mol Weight | 1103.3 g/mol |
Molecular Formula | C54H86O23 |
Exact Mass | 1102.555989 g/mol |
SpectraBase Spectrum ID | yaTxiTC9jJ |
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Name | TARASAPONIN-VI-METHYLESTER;BETA-D-GLUCOPYRANOSYL-OLEANOLATE-3-O-[BETA-D-XYLOPYRANOSYL-(1->2)]-[BETA-D-GALACTOPYRANOSYL-(1->3)]-BETA-D-GLUCURONOPYRA |
Compound Number | 5 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C54H86O23 |
InChI | InChI=1S/C54H86O23/c1-49(2)15-17-54(48(68)77-46-38(65)35(62)33(60)27(21-56)72-46)18-16-52(6)23(24(54)19-49)9-10-29-51(5)13-12-30(50(3,4)28(51)11-14-53(29,52)7)73-47-42(76-44-36(63)31(58)25(57)22-70-44)40(39(66)41(75-47)43(67)69-8)74-45-37(64)34(61)32(59)26(20-55)71-45/h9,24-42,44-47,55-66H,10-22H2,1-8H3/t24-,25+,26+,27+,28-,29+,30-,31-,32-,33+,34-,35-,36+,37+,38+,39-,40-,41-,42+,44-,45-,46-,47+,51-,52+,53+,54-/m0/s1 |
InChIKey | GDOPGDHWLRJHTG-BPWXWGEJSA-N |
Literature Reference Author | Y.SATOH,S.SAKAI,M.KATSUMATA,M.NAGASAO,M.MIYAKOSHI,Y.IDA,J.SH OJI |
Literature Reference Citation | PHYTOCHEM.,36,147(1994) |
Literature Reference DOI | 10.1016/S0031-9422(00)97028-6 |
Molecular Weight | 1103.263 g/mol |
Solvent | Unknown |
Source File Reference | UWLU25905 |