SpectraBase Compound ID | 9gJV6xCTft7 |
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InChI | InChI=1S/C53H86O20/c1-23-32(57)36(61)42(72-45-39(64)41(71-44-38(63)35(60)34(59)28(21-54)69-44)40(24(2)68-45)70-43-37(62)33(58)27(55)22-66-43)46(67-23)73-47(65)53-18-16-48(3,4)20-26(53)25-10-11-30-50(7)14-13-31(56)49(5,6)29(50)12-15-52(30,9)51(25,8)17-19-53/h10,23-24,26-46,54-64H,11-22H2,1-9H3/t23-,24+,26?,27-,28+,29?,30?,31+,32+,33+,34+,35-,36+,37-,38+,39-,40+,41+,42-,43+,44-,45+,46+,50+,51-,52-,53+/m1/s1 |
InChIKey | WJASPWXNVFZNHN-HQWMYJTJSA-N |
Mol Weight | 1043.3 g/mol |
Molecular Formula | C53H86O20 |
Exact Mass | 1042.571245 g/mol |
SpectraBase Spectrum ID | Ia99DhalEWj |
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Name | 28-O-[GLUCOPYRANOSYL-(1->3)-[XYLOPYRANOSYL-(1->4)]-RHAMNOPYRANOSYL-(1->2)-FUCOPYRANOSYL]-OLEANOLIC-ACID-ESTER |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C53H86O20 |
InChI | InChI=1S/C53H86O20/c1-23-32(57)36(61)42(72-45-39(64)41(71-44-38(63)35(60)34(59)28(21-54)69-44)40(24(2)68-45)70-43-37(62)33(58)27(55)22-66-43)46(67-23)73-47(65)53-18-16-48(3,4)20-26(53)25-10-11-30-50(7)14-13-31(56)49(5,6)29(50)12-15-52(30,9)51(25,8)17-19-53/h10,23-24,26-46,54-64H,11-22H2,1-9H3/t23-,24+,26?,27-,28+,29?,30?,31+,32+,33+,34+,35-,36+,37-,38+,39-,40+,41+,42-,43+,44-,45+,46+,50+,51-,52-,53+/m1/s1 |
InChIKey | WJASPWXNVFZNHN-HQWMYJTJSA-N |
Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
Molecular Weight | 1043.254 g/mol |
Solvent | C5D5N |
Source File Reference | UWVN1202 |