SpectraBase Compound ID | 2gAxhnlvMUF |
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InChI | InChI=1S/C51H82O22/c1-19(18-65-46-39(61)38(60)34(56)28(16-52)70-46)7-10-27-20(2)30-44(69-27)35(57)31-25-9-8-23-15-24(11-13-50(23,5)26(25)12-14-51(30,31)6)68-49-45(73-48-41(63)37(59)33(55)22(4)67-48)42(64)43(29(17-53)71-49)72-47-40(62)36(58)32(54)21(3)66-47/h8,19,21-22,24-26,28-49,52-64H,7,9-18H2,1-6H3/t19-,21-,22-,24-,25+,26-,28+,29+,30-,31+,32-,33-,34+,35?,36+,37+,38-,39+,40+,41+,42-,43+,44+,45+,46+,47-,48-,49+,50-,51+/m0/s1 |
InChIKey | MRHTVOYNFHEINX-OVHNMYDVSA-N |
Mol Weight | 1047.2 g/mol |
Molecular Formula | C51H82O22 |
Exact Mass | 1046.529774 g/mol |
SpectraBase Spectrum ID | 8MolNyAAkqX |
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Name | #1;15-HYDROXY-PSEUDOPROTODIOSCIN;(25R)-26-O-BETA-D-GLUCOPYRANOSYL-5,20-DIENE-3-BETA,15,26-TRIHYDROXY-FUROST-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-[ALPHA- |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C51H82O22 |
InChI | InChI=1S/C51H82O22/c1-19(18-65-46-39(61)38(60)34(56)28(16-52)70-46)7-10-27-20(2)30-44(69-27)35(57)31-25-9-8-23-15-24(11-13-50(23,5)26(25)12-14-51(30,31)6)68-49-45(73-48-41(63)37(59)33(55)22(4)67-48)42(64)43(29(17-53)71-49)72-47-40(62)36(58)32(54)21(3)66-47/h8,19,21-22,24-26,28-49,52-64H,7,9-18H2,1-6H3/t19-,21-,22-,24-,25+,26-,28+,29+,30-,31+,32-,33-,34+,35?,36+,37+,38-,39+,40+,41+,42-,43+,44+,45+,46+,47-,48-,49+,50-,51+/m0/s1 |
InChIKey | MRHTVOYNFHEINX-OVHNMYDVSA-N |
Literature Reference Author | H.L.HUANG,T.H.LIU,F.SHAO |
Literature Reference Citation | MAGN.RES.CHEM.,47,741(2009) |
Literature Reference DOI | 10.1002/mrc.2455 |
Molecular Weight | 1047.199 g/mol |
Solvent | C5D5N |
Source File Reference | UWLU80028 |