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| Standard English name | |
|---|---|
| Cas No. | 1151803-92-7 |
| Alias | 5-((4-(15-(3,5-di-tert-butylphenyl)-2,8,12,18-tetrahexyl-3,7,13,17-tetramethylporphyrin-5-yl)phenyl)ethynyl)-1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione |
| Canonical Smiles | CC1=C(CCCCCC)C2=CC3NC(C(=C4N=C(C=C5NC(=C(C1=N2)C1C=C(C=C(C=1)C(C)(C)C)C(C)(C)C)C(C)=C5CCCCCC)C(CCCCCC)=C4C)C1=CC=C(C=C1)C#CC1=CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)NC1=O)=C(C)C=3CCCCCC |
| MDL No. | |
| Exact Mass | 1,216.80682 |
| Smiles | OC[C@@H]1[C@H](C[C@H](N2C(NC(C(C#CC3=CC=C(/C4=C5C(C)=C(CCCCCC)C(/C=C6C(CCCCCC)=C(C)/C(N/6)=C(C7=CC(C(C)(C)C)=CC(C(C)(C)C)=C7)/C(C(C)=C/8CCCCCC)=NC8=C/C9=C(CCCCCC)C(C)=C4N9)=N\5)C=C3)=C2)=O)=O)O1)O |
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| Inchi | InChI=1S/C79H104N6O5/c1-15-19-23-27-31-59-49(5)72-70(54-38-35-53(36-39-54)37-40-55-47-85(77(89)84-76(55)88)69-46-67(87)68(48-86)90-69)73-50(6)60(32-28-24-20-16-2)64(81-73)45-66-62(34-30-26-22-18-4)52(8)75(83-66)71(56-41-57(78(9,10)11)43-58(42-56)79(12,13)14)74-51(7)61(33-29-25-21-17-3)65(82-74)44-63(59)80-72/h35-36,38-39,41-45,47,67-69,80,83,86-87H,15-34,46,48H2,1-14H3,(H,84,88,89)/b63-44?,64-45?,65-44-,66-45-,72-70?,73-70-,74-71?,75-71-/t67-,68+,69+/m0/s1 |
| InchiKey | IDKVKSLOSGSWSS-DRQCOUHYSA-N |
| Remark |
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