SpectraBase Compound ID | Lk8elDKoiQR |
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InChI | InChI=1S/C55H88O26/c1-20-8-11-55(72-17-20)21(2)34-30(81-55)13-27-25-7-6-23-12-24(9-10-53(23,4)26(25)14-33(60)54(27,34)5)74-51-46(79-50-42(68)39(65)35(61)22(3)73-50)43(69)44(32(16-57)76-51)77-52-47(80-49-41(67)37(63)29(59)19-71-49)45(38(64)31(15-56)75-52)78-48-40(66)36(62)28(58)18-70-48/h20-32,34-52,56-59,61-69H,6-19H2,1-5H3/t20-,21-,22-,23-,24-,25+,26-,27-,28+,29-,30-,31+,32+,34-,35-,36-,37-,38+,39+,40+,41+,42+,43-,44-,45-,46+,47+,48-,49-,50-,51+,52-,53-,54+,55+/m0/s1 |
InChIKey | FUFWMYZFCUYUFQ-OQGNWOHJSA-N |
Mol Weight | 1165.3 g/mol |
Molecular Formula | C55H88O26 |
Exact Mass | 1164.556383 g/mol |
SpectraBase Spectrum ID | E937582nzK7 |
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Name | CHLOROMALOSIDE_C;NEOHECOGENIN_3-O-BETA-D-XYLOPYRANOSYL-(1->3)-[ALPHA-L-ARABINOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSYL-(1->4)-[ALPHA-L- |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C55H88O26 |
InChI | InChI=1S/C55H88O26/c1-20-8-11-55(72-17-20)21(2)34-30(81-55)13-27-25-7-6-23-12-24(9-10-53(23,4)26(25)14-33(60)54(27,34)5)74-51-46(79-50-42(68)39(65)35(61)22(3)73-50)43(69)44(32(16-57)76-51)77-52-47(80-49-41(67)37(63)29(59)19-71-49)45(38(64)31(15-56)75-52)78-48-40(66)36(62)28(58)18-70-48/h20-32,34-52,56-59,61-69H,6-19H2,1-5H3/t20-,21-,22-,23-,24-,25+,26-,27-,28+,29-,30-,31+,32+,34-,35-,36-,37-,38+,39+,40+,41+,42+,43-,44-,45-,46+,47+,48-,49-,50-,51+,52-,53-,54+,55+/m0/s1 |
InChIKey | FUFWMYZFCUYUFQ-OQGNWOHJSA-N |
Literature Reference Author | X.C.LI,D.Z.WANG,C.R.YANG |
Literature Reference Citation | PHYTOCHEM.,29,3893(1990) |
Literature Reference DOI | 10.1016/0031-9422(90)85354-I |
Molecular Weight | 1165.288 g/mol |
Solvent | C5D5N |
Source File Reference | UWMZ19522 |