| SpectraBase Compound ID | IkFZheygoZr |
|---|---|
| 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/h8,19,22-30,37-41H,2,9-18H2,1,3-7H3/t19-,22-,23+,24-,25+,26+,27-,28+,29-,30+,33+,34-,35-,36+/m1/s1 |
| InChIKey | DNCUEXRQNLQLJB-NODZZJBVSA-N |
| Mol Weight | 616.8 g/mol |
| Molecular Formula | C36H56O8 |
| Exact Mass | 616.397519 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LoM6bP8puVP |
|---|---|
| Name | 3-BETA-HYDROXY-URS-12,19(29)-DIEN-28-OIC-ACID-BETA-D-GLUCOPYRANOSYLESTER |
| Compound Number | 12 |
| 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/h8,19,22-30,37-41H,2,9-18H2,1,3-7H3/t19-,22-,23+,24-,25+,26+,27-,28+,29-,30+,33+,34-,35-,36+/m1/s1 |
| InChIKey | DNCUEXRQNLQLJB-NODZZJBVSA-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 | UWMS3428 |