SpectraBase Compound ID | AUXWP0WcDO6 |
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InChI | InChI=1S/C65H106O31/c1-25-36(70)40(74)45(79)54(87-25)94-51-31(22-68)90-53(49(83)44(51)78)86-24-32-39(73)43(77)48(82)57(91-32)96-59(84)65-17-15-60(2,3)19-27(65)26-9-10-34-62(6)13-12-35(61(4,5)33(62)11-14-64(34,8)63(26,7)16-18-65)92-58-52(95-56-47(81)42(76)38(72)30(21-67)89-56)50(28(69)23-85-58)93-55-46(80)41(75)37(71)29(20-66)88-55/h9,25,27-58,66-83H,10-24H2,1-8H3/t25-,27?,28+,29-,30+,31-,32-,33?,34?,35+,36-,37-,38+,39-,40+,41+,42-,43+,44-,45+,46-,47+,48-,49-,50+,51-,52-,53-,54-,55+,56-,57+,58+,62+,63-,64-,65+/m1/s1 |
InChIKey | WKFFFKKWDNJSNL-BEIICISRSA-N |
Mol Weight | 1383.5 g/mol |
Molecular Formula | C65H106O31 |
Exact Mass | 1382.671807 g/mol |
SpectraBase Spectrum ID | GMLqkZhHLiw |
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Name | LEONTICIN-E;3-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID-28-O-ALPHA-L-RHAMNOPYRANOSYL- |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C65H106O31 |
InChI | InChI=1S/C65H106O31/c1-25-36(70)40(74)45(79)54(87-25)94-51-31(22-68)90-53(49(83)44(51)78)86-24-32-39(73)43(77)48(82)57(91-32)96-59(84)65-17-15-60(2,3)19-27(65)26-9-10-34-62(6)13-12-35(61(4,5)33(62)11-14-64(34,8)63(26,7)16-18-65)92-58-52(95-56-47(81)42(76)38(72)30(21-67)89-56)50(28(69)23-85-58)93-55-46(80)41(75)37(71)29(20-66)88-55/h9,25,27-58,66-83H,10-24H2,1-8H3/t25-,27?,28+,29-,30+,31-,32-,33?,34?,35+,36-,37-,38+,39-,40+,41+,42-,43+,44-,45+,46-,47+,48-,49-,50+,51-,52-,53-,54-,55+,56-,57+,58+,62+,63-,64-,65+/m1/s1 |
InChIKey | WKFFFKKWDNJSNL-BEIICISRSA-N |
Literature Reference Author | M.CHEN,W.W.WU,D.NANZ,O.STICHER |
Literature Reference Citation | PHYTOCHEM.,44,497(1997) |
Literature Reference DOI | 10.1016/S0031-9422(96)00546-8 |
Molecular Weight | 1383.538 g/mol |
Solvent | C5D5N:CD3OD |
Source File Reference | UWPA147 |