基本信息 |
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产品名称: | SANDRAMYCIN |
CAS: | 100940-65-6 |
英文同义词: | SANDRAMYCIN |
MDL号: | MFCD09752757 |
氢键受体数量: | 28 |
氢键供体数量: | 6 |
Smile: | CC(C)C1C(=O)OCC(C(=O)N2CCCCC2C(=O)NCC(=O)N(CC(=O)N(C(C(=O)OCC(C(=O)N3CCCCC3C(=O)NCC(=O)N(CC(=O)N1C)C)NC(=O)c4c(cc5ccccc5n4)O)C(C)C)C)C)NC(=O)c6c(cc7ccccc7n6)O |
InChi: | InChI=1S/C60H76N12O16/c1-33(2)51-59(85)87-31-39(65-55(81)49-43(73)25-35-17-9-11-19-37(35)63-49)57(83)71-23-15-13-21-41(71)53(79)62-28-46(76)68(6)30-48(78)70(8)52(34(3)4)60(86)88-32-40(66-56(82)50-44(74)26-36-18-10-12-20-38(36)64-50)58(84)72-24-16-14-22-42(72)54(80)61-27-45(75)67(5)29-47(77)69(51)7/h9-12,17-20,25-26,33-34,39-42,51-52,73-74H,13-16,21-24,27-32H2,1-8H3,(H,61,80)(H,62,79)(H,65,81)(H,66,82) |
InChiKey: | InChIKey=WXIVYIYCEBUEHL-UHFFFAOYSA-N |
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