SpectraBase Compound ID | 8ObwPCdAljQ |
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InChI | InChI=1S/C71H112O35/c1-26-37(76)42(81)47(86)60(95-26)102-52-38(77)27(2)96-63(55(52)104-61-49(88)44(83)51(28(3)97-61)100-58-45(84)39(78)31(74)23-93-58)106-65(91)71-19-17-66(4,5)21-30(71)29-11-12-35-67(6)15-14-36(68(7,25-73)34(67)13-16-70(35,9)69(29,8)18-20-71)99-64-56(105-62-48(87)43(82)41(80)33(22-72)98-62)53(50(89)54(103-64)57(90)92-10)101-59-46(85)40(79)32(75)24-94-59/h11,25-28,30-56,58-64,72,74-89H,12-24H2,1-10H3/t26-,27-,28+,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-,58-,59+,60-,61+,62-,63+,64-,67+,68+,69-,70-,71+/m1/s1 |
InChIKey | RNAGWRIYFVHGDL-FFBQXMMHSA-N |
Mol Weight | 1525.6 g/mol |
Molecular Formula | C71H112O35 |
Exact Mass | 1524.698415 g/mol |
SpectraBase Spectrum ID | LTadQRPm2sR |
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Name | LUPEROSIDE-I;3-O-BETA-[GALACTOPYRANOSYL-(1->2)-[ARABINOPYRANOSYL-(1->3)]-(6-O-METHYL)-GLUCURONOPYRANOSYL]-28-O-[XYLOPYRANOSYL-(1->4)-RHAMNOPYRANO |
Compound Number | 106 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C71H112O35 |
InChI | InChI=1S/C71H112O35/c1-26-37(76)42(81)47(86)60(95-26)102-52-38(77)27(2)96-63(55(52)104-61-49(88)44(83)51(28(3)97-61)100-58-45(84)39(78)31(74)23-93-58)106-65(91)71-19-17-66(4,5)21-30(71)29-11-12-35-67(6)15-14-36(68(7,25-73)34(67)13-16-70(35,9)69(29,8)18-20-71)99-64-56(105-62-48(87)43(82)41(80)33(22-72)98-62)53(50(89)54(103-64)57(90)92-10)101-59-46(85)40(79)32(75)24-94-59/h11,25-28,30-56,58-64,72,74-89H,12-24H2,1-10H3/t26-,27-,28+,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-,58-,59+,60-,61+,62-,63+,64-,67+,68+,69-,70-,71+/m1/s1 |
InChIKey | RNAGWRIYFVHGDL-FFBQXMMHSA-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 | 1525.649 g/mol |
Solvent | C5D5N |
Source File Reference | UWVN1341 |