SpectraBase Compound ID | G6HZzNoY3Ag |
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InChI | InChI=1S/C37H56O11/c1-32(2)21-10-13-36(6)22(34(21,4)12-11-23(32)47-29-26(40)24(38)25(39)27(48-29)28(41)42)9-8-19-20-18-33(3,31(45)46-7)14-16-37(20,30(43)44)17-15-35(19,36)5/h8,20-27,29,38-40H,9-18H2,1-7H3,(H,41,42)(H,43,44)/t20?,21?,22?,23-,24-,25-,26+,27-,29+,33-,34-,35+,36+,37-/m0/s1 |
InChIKey | AYVNWDSXMFBLOM-CZQBOAOTSA-N |
Mol Weight | 676.8 g/mol |
Molecular Formula | C37H56O11 |
Exact Mass | 676.382263 g/mol |
SpectraBase Spectrum ID | IpLUaGEy6uA |
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Name | 3-O-BETA-[GLUCURONOPYRANOSYL]-METHYL-SPERGULAGENATE |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C37H56O11 |
InChI | InChI=1S/C37H56O11/c1-32(2)21-10-13-36(6)22(34(21,4)12-11-23(32)47-29-26(40)24(38)25(39)27(48-29)28(41)42)9-8-19-20-18-33(3,31(45)46-7)14-16-37(20,30(43)44)17-15-35(19,36)5/h8,20-27,29,38-40H,9-18H2,1-7H3,(H,41,42)(H,43,44)/t20?,21?,22?,23-,24-,25-,26+,27-,29+,33-,34-,35+,36+,37-/m0/s1 |
InChIKey | AYVNWDSXMFBLOM-CZQBOAOTSA-N |
Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
Molecular Weight | 676.845 g/mol |
Solvent | C5D5N |
Source File Reference | UWVN1329 |