basic_info |
|
| Product_Name: | ACTINOMYCIN C3 |
| CAS: | 6156-47-4 |
| EnglishSynonyms: | ACTINOMYCIN C3 |
| pro_mdlNumber: | MFCD01673940 |
| pro_acceptors: | 28 |
| pro_donors: | 5 |
| pro_smile: | CC[C@H](C)[C@@H]1C(=O)N2CCC[C@H]2C(=O)N(CC(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)c3ccc(c4c3nc-5c(c(c(=O)c(c5o4)C)N)C(=O)N[C@H]6[C@H](OC(=O)[C@@H](N(C(=O)CN(C(=O)[C@@H]7CCCN7C(=O)[C@H](NC6=O)[C@@H](C)CC)C)C)C(C)C)C)C)C)C(C)C)C)C |
| InChi: | InChI=1S/C64H90N12O16/c1-17-31(7)44-61(86)75-25-19-21-38(75)59(84)71(13)27-40(77)73(15)50(29(3)4)63(88)90-35(11)46(57(82)67-44)69-55(80)37-24-23-33(9)53-48(37)66-49-42(43(65)52(79)34(10)54(49)92-53)56(81)70-47-36(12)91-64(89)51(30(5)6)74(16)41(78)28-72(14)60(85)39-22-20-26-76(39)62(87)45(32(8)18-2)68-58(47)83/h23-24,29-32,35-36,38-39,44-47,50-51H,17-22,25-28,65H2,1-16H3,(H,67,82)(H,68,83)(H,69,80)(H,70,81)/t31-,32-,35+,36+,38-,39-,44+,45+,46-,47-,50-,51-/m0/s1 |
| InChiKey: | InChIKey=XLGPRYUFOGVPMM-WUXANXDBSA-N |
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