| SpectraBase Spectrum ID |
LCf0ViXPAzq |
| Name |
(-)-Dimethyl (.beta.S.beta.'S)-dimethylmesobilirubinate XIII.alpha. |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C37H48N4O6 |
| InChI |
InChI=1S/C37H48N4O6/c1-11-24-20(5)36(44)40-28(24)15-26-22(7)34(18(3)13-32(42)46-9)30(38-26)17-31-35(19(4)14-33(43)47-10)23(8)27(39-31)16-29-25(12-2)21(6)37(45)41-29/h15-16,18-19,38-39H,11-14,17H2,1-10H3,(H,40,44)(H,41,45)/b28-15-,29-16-/t18-,19-/m0/s1 |
| InChIKey |
GTVUUMDGHKRWOU-ADRYAUDLSA-N |
| Molecular Weight |
644.813 g/mol |
| SMILES |
[nH]1c(\C=C/2NC(C(=C2CC)C)=O)c(c([C@](CC(=O)OC)(C)[H])c1Cc1c(c(C)c([nH]1)\C=C/1NC(C(=C1CC)C)=O)[C@](CC(=O)OC)(C)[H])C |
| SPLASH |
splash10-014i-0009004000-2d2ed6dc217833f17f7f |
| Source of Spectrum |
QC-5-1960-2 |
| Wiley ID |
883824 |
