SpectraBase Compound ID | HrjXpUh0Tht |
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InChI | InChI=1S/C36H56O8/c1-19-10-15-36(31(42)44-30-29(41)28(40)27(39)22(18-37)43-30)17-16-34(6)21(26(36)20(19)2)8-9-24-33(5)13-12-25(38)32(3,4)23(33)11-14-35(24,34)7/h8,19,22-25,27-30,37-41H,9-18H2,1-7H3/t19-,22+,23-,24+,25-,27+,28-,29+,30-,33-,34+,35+,36-/m0/s1 |
InChIKey | CXGOMVYPTVALJI-QEXVYVHDSA-N |
Mol Weight | 616.8 g/mol |
Molecular Formula | C36H56O8 |
Exact Mass | 616.397519 g/mol |
SpectraBase Spectrum ID | HnF6jhEATHk |
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Name | 3-BETA-HYDROXY-URS-12,18(19)-DIEN-28-OIC-ACID-BETA-D-GLUCOPYRANOSYLESTER |
Compound Number | 11 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C36H56O8 |
InChI | InChI=1S/C36H56O8/c1-19-10-15-36(31(42)44-30-29(41)28(40)27(39)22(18-37)43-30)17-16-34(6)21(26(36)20(19)2)8-9-24-33(5)13-12-25(38)32(3,4)23(33)11-14-35(24,34)7/h8,19,22-25,27-30,37-41H,9-18H2,1-7H3/t19-,22+,23-,24+,25-,27+,28-,29+,30-,33-,34+,35+,36-/m0/s1 |
InChIKey | CXGOMVYPTVALJI-QEXVYVHDSA-N |
Literature Reference Author | Y.H.ZHANG,J.K.CHENG,L.YANG,D.L.CHENG |
Literature Reference Citation | J.CHIN.CHEM.SOC.,49,117(2002) |
Literature Reference DOI | 10.1002/jccs.200200020 |
Molecular Weight | 616.836 g/mol |
Solvent | C5D5N |
Source File Reference | UWMS3427 |