chlorophyllide a

Properties Image MNX_ID MNXM1108183 reference chebi:16900 formula C35H34MgN4O5 global charge 0 mol weight 614.985 InChIKey ANWUQYTXRXCEMZ-NYABAGMLSA-L InChI InChI=1S/C35H36N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2/p-2/t17-,21-,31+;/m0./s1 SMILES C=CC1=C2C=C3C(C)=C(CC)C4=[N+]3[Mg-2]35N2C(=C1C)C=C1[C@@H](C)[C@H](CCC(=O)O)C(=[N+]13)C1=C2C(=C(C)C(=C4)N25)C(=O)[C@@H]1C(=O)OC MNX internals InChI (mnx) InChI=1/C35H36N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8,12-14,17,21,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2/t17-,21-,31+;/m0./s1 SMILES (mnx) [CH2:1]=[CH:8][C:19]1=[C:15]([CH3:3])[C:22]2=[CH:12][C:24]3=[N:38][C:32](=[C:30]4[C@@H:31]([C:35](=[O:43])[O:44][CH3:7])[C:34](=[O:42])[C:29]5=[C:18]([CH3:6])[C:25](=[CH:14][C:27]6=[C:20]([CH2:9][CH3:2])[C:16]([CH3:4])=[C:23]([CH:13]=[C:26]1[N-:36]2)[NH2+:37]6)[N:39]=[C:33]54)[C@@H:21]([CH2:10][CH2:11][C:28](=[O:40])[OH:41])[C@@H:17]3[CH3:5].[Mg+2:45]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 46 in models (compartimentalized) 4