Dolastatin 16

Properties Image Occurences in reactions MNX_ID MNXM104681 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C47H70N6O10 charge 0 mass 878.51534 reference chebi:67337 InChIKey JXOFEBNJOOEXJY-QNCIAAGJSA-N InChI InChI=1S/C47H70N6O10/c1-26(2)36-30(8)46(60)62-31(9)42(56)53-24-16-21-35(53)47(61)63-39(28(5)6)45(59)50(10)38(27(3)4)44(58)52-23-15-20-34(52)41(55)49-37(29(7)25-32-17-12-11-13-18-32)43(57)51-22-14-19-33(51)40(54)48-36/h11-13,17-18,26-31,33-39H,14-16,19-25H2,1-10H3,(H,48,54)(H,49,55)/t29-,30-,31+,33+,34+,35+,36-,37+,38-,39-/m1/s1 SMILES CC(C)[C@H]1OC(=O)[C@@H]2CCCN2C(=O)[C@H](C)OC(=O)[C@H](C)[C@@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H]([C@H](C)Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](C(C)C)N(C)C1=O

Parent-child relations graph

Deprecated MNXref IDs graph