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SMILES: C1(=O)CC2=CCC3C(C2(CC1)C)CC1=C(C2(CCC31)O[C@H]1C([C@H]2C)N(CC(C1)C)CCNC(=O)CCCCCNC(=O)CCc1ccccc1)C Canonical SMILES: CC1CN(CCNC(=O)CCCCCNC(=O)CCc2ccccc2)C2[C@@H](C1)OC1([C@@H]2C)CCC2C(=C1C)CC1C2CC=C2C1(C)CCC(=O)C2 InChI: InChI=1S/C44H63N3O4/c1-29-25-39-42(47(28-29)24-23-46-40(49)13-9-6-10-22-45-41(50)17-14-32-11-7-5-8-12-32)31(3)44(51-39)21-19-35-36-16-15-33-26-34(48)18-20-43(33,4)38(36)27-37(35)30(44)2/h5,7-8,11-12,15,29,31,35-36,38-39,42H,6,9-10,13-14,16-28H2,1-4H3,(H,45,50)(H,46,49)/t29?,31-,35?,36?,38?,39-,42?,43?,44?/m1/s1 InChIKey: WDHRPWOAMDJICD-BWBMXWGBSA-N
CBID:172042 http://www.chembase.cn/molecule-172042.html