| SpectraBase Spectrum ID |
6PEzYDAEWSo |
| Name |
Dimethyl 1,19,21,24-tetrahydro-3,12,13,17-tetramethyl-1,19-dioxo-22-thia-22-deazabilin-2,18-dipropanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H33N3O6S |
| InChI |
InChI=1S/C31H33N3O6S/c1-16-17(2)26(15-27-19(4)23(31(38)34-27)10-12-29(36)40-6)32-24(16)13-20-7-8-21(41-20)14-25-18(3)22(30(37)33-25)9-11-28(35)39-5/h7-8,13-15H,9-12H2,1-6H3,(H,33,37)(H,34,38)/b24-13+,25-14+,27-15+ |
| InChIKey |
SHPFIFNUYQXFBM-HNMHDSJISA-N |
| Molecular Weight |
575.680 g/mol |
| SMILES |
N1\C(=C\C2=N\C(=C\c3sc(\C=C\4C(=C(C(N4)=O)CCC(=O)OC)C)cc3)C(=C2C)C)C(=C(CCC(=O)OC)C1=O)C |
| SPLASH |
splash10-0a4i-9000010000-d5947a6641bde54d011f |
| Source of Spectrum |
H-77-1848-8 |
| Synonyms |
Methyl 3-[(5E)-5-({5-[(E)-(5-{(E)-[4-(3-methoxy-3-oxopropyl)-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene]methyl}-3,4-dimethyl-2H-pyrrol-2-ylidene)methyl]-2-thienyl}methylene)-4-methyl-2-oxo-2,5-dihydro-1H-pyrrol-3-yl]propanoate |
| Wiley ID |
1408130 |
