| SpectraBase Spectrum ID |
5Ex7KTJZhI |
| Name |
21H-Biline-3-acetamide, 17-ethyl-1,2,3,19,23,24-hexahydro-2,2,7,8,12,13,18-heptamethyl-N-[1-(4-nitrophenyl)ethyl]-1,19-dioxo-, [3R(R)]- |
| CAS Registry Number |
100923-13-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C38H44N6O5 |
| InChI |
InChI=1S/C38H44N6O5/c1-10-27-23(6)36(46)42-33(27)17-31-21(4)19(2)29(40-31)16-30-20(3)22(5)32(41-30)18-34-28(38(8,9)37(47)43-34)15-35(45)39-24(7)25-11-13-26(14-12-25)44(48)49/h11-14,16-18,24,28,33,40H,10,15H2,1-9H3,(H,39,45)(H,42,46)/b29-16-,31-17-,32-18-/t24?,28-,33?/m0/s1 |
| InChIKey |
HLBASZDHVYZCCY-LXQILRKYSA-N |
| Molecular Weight |
664.807 g/mol |
| SMILES |
N1\C(=C/C2=N\C(=C/C3=NC(C([C@]3(CC(NC(c3ccc(N(=O)=O)cc3)C)=O)[H])(C)C)=O)C(=C2C)C)C(=C(C)\C1=C/C1NC(C(=C1CC)C)=O)C |
| SPLASH |
splash10-022d-0848409000-875cee40800f2e680307 |
| Source of Spectrum |
AH-116-1078-9 |
| Synonyms |
(3R)-(4Z,9Z,15Z)-17-ethyl-1,19-dioxo-2,2,7,8,12,13,18-heptamethyl-1,2,3,19,23,24-hexahydro-21H-bilin-3-(R)-1-(4-nitrophenyl)ethyl-acetamide
2-((4R)-5-{(Z)-[5-((Z)-{(5Z)-5-[(3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)methylene]-3,4-dimethyl-1,5-dihydro-2H-pyrrol-2-ylidene}methyl)-3,4-dimethyl-2H-pyrrol-2-ylidene]methyl}-3,3-dimethyl-2-oxo-3,4-dihydro-2H-pyrrol-4-yl)-N-[1-(4-nitrophenyl)ethyl]acetamide |
| Wiley ID |
1413707 |
![21H-Biline-3-acetamide, 17-ethyl-1,2,3,19,23,24-hexahydro-2,2,7,8,12,13,18-heptamethyl-N-[1-(4-nitrophenyl)ethyl]-1,19-dioxo-, [3R(R)]-](/api/spectrum/5Ex7KTJZhI/structure.png?h=300&w=458 "21H-Biline-3-acetamide, 17-ethyl-1,2,3,19,23,24-hexahydro-2,2,7,8,12,13,18-heptamethyl-N-[1-(4-nitrophenyl)ethyl]-1,19-dioxo-, [3R(R)]-")
