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| Chemical manufacturer | ||||
| Name | Pheophytin B |
|---|---|
| Synonyms | 3-Phorbinepropanoic Acid, 9-Ethenyl-14-Ethyl-13-Formyl-21-(Methoxycarbonyl)-4,8,18-Trimethyl-20-Oxo-, (2E,7R,11R)-3,7,11,15-Tetramethyl-2-Hexadecenyl Ester, (3S,4S,21R)- |
| Molecular Structure |  |
| Molecular Formula | C55H72N4O6 |
| Molecular Weight | 885.20 |
| CAS Registry Number | 3147-18-0 |
| EINECS | 221-565-1 |
| SMILES | C(C1C(C3=NC1=C5C(C(=O)C6=C(C(=CC2=C(C(=C([NH]2)C=C4[NH]C(=C3)C(=C4C=C)C)C=O)CC)N=C56)C)C(OC)=O)C)CC(OC/C=C(/CCCC(CCCC(CCCC(C)C)C)C)C)=O |
| InChI | 1S/C55H72N4O6/c1-12-38-35(8)42-27-43-36(9)40(23-24-48(61)65-26-25-34(7)22-16-21-33(6)20-15-19-32(5)18-14-17-31(3)4)52(58-43)50-51(55(63)64-11)54(62)49-37(10)44(59-53(49)50)28-46-39(13-2)41(30-60)47(57-46)29-45(38)56-42/h12,25,27-33,36,40,51,56-57H,1,13-24,26H2,2-11H3/b34-25+,42-27?,43-27?,44-28?,45-29?,46-28?,47-29?,52-50? |
| InChIKey | SVNJLRKERVRIRJ-IZLXFOMKSA-N |
| Density | 1.132g/cm3 (Cal.) |
|---|---|
| Boiling point | 1071.605°C at 760 mmHg (Cal.) |
| Flash point | 601.885°C (Cal.) |
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