basic_info |
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Product_Name: | FK 224 |
CAS: | 125787-94-2 |
EnglishSynonyms: | FK 224 |
pro_mdlNumber: | MFCD00887324 |
pro_acceptors: | 21 |
pro_donors: | 10 |
pro_smile: | CCCCCc1ccccc1CCC(=O)N[C@H]2[C@H](OC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)/C(=C/c3ccc(cc3)O)/N(C2=O)C)CC(C)C)Cc4ccccc4)[C@H](C)O)CC(=O)N)CO)C |
InChi: | InChI=1S/C54H72N8O13/c1-7-8-10-17-36-18-13-14-19-37(36)22-25-45(67)60-47-33(5)75-54(74)42(30-63)59-49(69)41(29-44(55)66)58-52(72)46(32(4)64)61-50(70)40(27-34-15-11-9-12-16-34)56-48(68)39(26-31(2)3)57-51(71)43(62(6)53(47)73)28-35-20-23-38(65)24-21-35/h9,11-16,18-21,23-24,28,31-33,39-42,46-47,63-65H,7-8,10,17,22,25-27,29-30H2,1-6H3,(H2,55,66)(H,56,68)(H,57,71)(H,58,72)(H,59,69)(H,60,67)(H,61,70)/b43-28-/t32-,33+,39-,40+,41-,42-,46-,47-/m0/s1 |
InChiKey: | InChIKey=BEWCDVTWUFJSSM-QTTFJXBSSA-N |
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