SpectraBase Compound ID | GmykAyA5ERx |
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InChI | InChI=1S/C51H84O23/c1-20(19-66-45-40(62)38(60)34(56)29(16-52)69-45)8-13-51(65)21(2)32-28(74-51)15-27-25-7-6-23-14-24(9-11-49(23,4)26(25)10-12-50(27,32)5)68-48-44(73-46-41(63)37(59)33(55)22(3)67-46)43(36(58)31(18-54)71-48)72-47-42(64)39(61)35(57)30(17-53)70-47/h6,20-22,24-48,52-65H,7-19H2,1-5H3/t20-,21+,22-,24+,25-,26+,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?/m1/s1 |
InChIKey | GMCGZPQYTRHQRU-FEUROBFMSA-N |
Mol Weight | 1065.2 g/mol |
Molecular Formula | C51H84O23 |
Exact Mass | 1064.540339 g/mol |
SpectraBase Spectrum ID | Dql5V82KYoQ |
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Name | #14;INDIOSIDE-D;26-O-BETA-D-GLUCOPYRANOSYL-3-BETA,22-XI,26-TRIHYDROXY-(25R)-FUROST-5-ENE-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[(BETA-D-GLUCOPYRANOSYL-(1->3)]-BE |
Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C51H84O23 |
InChI | InChI=1S/C51H84O23/c1-20(19-66-45-40(62)38(60)34(56)29(16-52)69-45)8-13-51(65)21(2)32-28(74-51)15-27-25-7-6-23-14-24(9-11-49(23,4)26(25)10-12-50(27,32)5)68-48-44(73-46-41(63)37(59)33(55)22(3)67-46)43(36(58)31(18-54)71-48)72-47-42(64)39(61)35(57)30(17-53)70-47/h6,20-22,24-48,52-65H,7-19H2,1-5H3/t20-,21+,22-,24+,25-,26+,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?/m1/s1 |
InChIKey | GMCGZPQYTRHQRU-FEUROBFMSA-N |
Literature Reference Author | P.K.AGRAWAL |
Literature Reference Citation | STEROIDS,70,715(2005) |
Literature Reference DOI | 10.1016/j.steroids.2005.04.001 |
Molecular Weight | 1065.214 g/mol |
Sample ID | 968759 |
Solvent | C5D5N |