SpectraBase Compound ID | 2NvotENFb11 |
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InChI | InChI=1S/C58H88O30/c1-21-15-79-58(48(72)43(21)84-51-41(70)39(68)38(67)34(14-59)82-51)30(16-75-23(3)61)36-33(88-58)13-29-27-8-7-25-11-26(63)12-35(56(25,6)28(27)9-10-55(29,36)5)83-53-47(45(32(65)18-77-53)85-50-40(69)37(66)31(64)17-76-50)87-52-42(71)46(44(22(2)80-52)81-24(4)62)86-54-49(73)57(74,19-60)20-78-54/h7,22,26-54,59-60,63-74H,1,8-20H2,2-6H3/t22-,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-,52-,53-,54-,55+,56+,57+,58+/m1/s1 |
InChIKey | CNMUHJHUNBTJQI-IBTGVYJCSA-N |
Mol Weight | 1265.3 g/mol |
Molecular Formula | C58H88O30 |
Exact Mass | 1264.536041 g/mol |
SpectraBase Spectrum ID | 4VGo5cLCcWV |
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Name | (23S,24S)-21-ACETOXY-24-[(O-BETA-D-GLUCOPYRANOSYL)-OXY]-3-BETA,23-DIHYDROXYSPIROSTA-5,25(27)-DIEN-1-BETA-YL-O-BETA-D-APIOFURANOSYL-(1->3)-O-(4-O-AC |
Compound Number | 7 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C58H88O30 |
InChI | InChI=1S/C58H88O30/c1-21-15-79-58(48(72)43(21)84-51-41(70)39(68)38(67)34(14-59)82-51)30(16-75-23(3)61)36-33(88-58)13-29-27-8-7-25-11-26(63)12-35(56(25,6)28(27)9-10-55(29,36)5)83-53-47(45(32(65)18-77-53)85-50-40(69)37(66)31(64)17-76-50)87-52-42(71)46(44(22(2)80-52)81-24(4)62)86-54-49(73)57(74,19-60)20-78-54/h7,22,26-54,59-60,63-74H,1,8-20H2,2-6H3/t22-,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-,52-,53-,54-,55+,56+,57+,58+/m1/s1 |
InChIKey | CNMUHJHUNBTJQI-IBTGVYJCSA-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 | 1265.319 g/mol |
Solvent | C5D5N |
Source File Reference | UWSI4504 |