Lagunamide B

Properties Image Occurences in reactions MNX_ID MNXM106025 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C45H69N5O10 charge 0 mass 839.50444 reference chebi:70391 InChIKey AEOXIHQSVQNFCU-PCOXENEKSA-N InChI InChI=1S/C45H69N5O10/c1-14-26(4)37-43(56)49(12)32(10)45(58)59-38(27(5)15-2)30(8)35(51)23-22-29(7)44(57)60-39(28(6)16-3)40(53)46-31(9)41(54)50(13)34(24-33-20-18-17-19-21-33)42(55)48(11)25-36(52)47-37/h15,17-22,26,28,30-32,34-35,37-39,51H,14,16,23-25H2,1-13H3,(H,46,53)(H,47,52)/b27-15+,29-22+/t26-,28+,30+,31+,32+,34-,35+,37+,38+,39-/m1/s1 SMILES C/C=C(\C)[C@@H]1OC(=O)[C@H](C)N(C)C(=O)[C@H]([C@H](C)CC)NC(=O)CN(C)C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@H](C)NC(=O)[C@@H]([C@@H](C)CC)OC(=O)/C(C)=C/C[C@H](O)[C@@H]1C

Parent-child relations graph

Deprecated MNXref IDs graph