SpectraBase Compound ID | F3MefwWPSvC |
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InChI | InChI=1S/C58H88O29/c1-21-15-78-58(48(71)43(21)83-51-41(69)39(67)37(65)22(2)79-51)31(16-74-24(4)60)36-34(87-58)14-30-28-9-8-26-12-27(62)13-35(56(26,7)29(28)10-11-55(30,36)6)82-53-47(45(33(64)18-76-53)84-50-40(68)38(66)32(63)17-75-50)86-52-42(70)46(44(23(3)80-52)81-25(5)61)85-54-49(72)57(73,19-59)20-77-54/h8,22-23,27-54,59,62-73H,1,9-20H2,2-7H3/t22-,23+,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-/m0/s1 |
InChIKey | GWKXWFUKJVEVIT-MJJFVQRESA-N |
Mol Weight | 1249.3 g/mol |
Molecular Formula | C58H88O29 |
Exact Mass | 1248.541127 g/mol |
SpectraBase Spectrum ID | EwpxAnhZ2jO |
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Name | (23S,24S)-21-ACETOXY-3-BETA,23-DIHYDROXY-24-[(O-BETA-D-QUINOVOPYRANOSYL)-OXY]-SPIROSTA-5,25(27)-DIEN-1-BETA-YL-O-BETA-D-APIOFURANOSYL-(1->3)-O-(4-O |
Compound Number | 8 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C58H88O29 |
InChI | InChI=1S/C58H88O29/c1-21-15-78-58(48(71)43(21)83-51-41(69)39(67)37(65)22(2)79-51)31(16-74-24(4)60)36-34(87-58)14-30-28-9-8-26-12-27(62)13-35(56(26,7)29(28)10-11-55(30,36)6)82-53-47(45(33(64)18-76-53)84-50-40(68)38(66)32(63)17-75-50)86-52-42(70)46(44(23(3)80-52)81-25(5)61)85-54-49(72)57(73,19-59)20-77-54/h8,22-23,27-54,59,62-73H,1,9-20H2,2-7H3/t22-,23+,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-/m0/s1 |
InChIKey | GWKXWFUKJVEVIT-MJJFVQRESA-N |
Literature Reference Author | K.WATANABE,Y.MIMAKI,H.SAKAGAMI,Y.SASHIDA |
Literature Reference Citation | J.NAT.PROD.,66,236(2003) |
Literature Reference DOI | 10.1021/np0203638 |
Molecular Weight | 1249.319 g/mol |
Solvent | C5D5N |
Source File Reference | UWSI4505 |