Hypromellose phthtalate (JP18/NF)

Properties Image MNX_ID MNXM57010 reference keggD:D01536 formula C36H44O18*2 global charge 0 mol weight   InChIKey   InChI   SMILES [*]O[C@H]1[C@H](OC(=O)C2=C(C(=O)O)C=CC=C2)[C@@H](OC)[C@H](O[C@H]2[C@H](OC)[C@@H](OC(=O)C3=C(C(=O)O)C=CC=C3)C([*])O[C@@H]2COC(C)(C)O)O[C@@H]1COC(C)(C)O MNX internals InChI (mnx) InChI=1/C38H50O18/c1-19-26(54-34(43)22-15-11-9-13-20(22)32(39)40)29(48-7)28(25(52-19)18-51-38(4,5)46)56-36-31(49-8)30(27(47-6)24(53-36)17-50-37(2,3)45)55-35(44)23-16-12-10-14-21(23)33(41)42/h9-16,19,24-31,36,45-46H,17-18H2,1-8H3,(H,39,40)(H,41,42)/t19?,24-,25-,26+,27-,28-,29-,30+,31-,36+/m1/s1/i1+1,6+1 SMILES (mnx) [13CH3:1][CH:19]1[C@H:26]([O:54][C:34]([C:22]2=[CH:15][CH:11]=[CH:9][CH:13]=[C:20]2[C:32](=[O:39])[OH:40])=[O:43])[C@@H:29]([O:48][CH3:7])[C@H:28]([O:56][C@H:36]2[C@H:31]([O:49][CH3:8])[C@@H:30]([O:55][C:35]([C:23]3=[CH:16][CH:12]=[CH:10][CH:14]=[C:21]3[C:33](=[O:41])[OH:42])=[O:44])[C@H:27]([O:47][13CH3:6])[C@@H:24]([CH2:17][O:50][C:37]([CH3:2])([CH3:3])[OH:45])[O:53]2)[C@@H:25]([CH2:18][O:51][C:38]([CH3:4])([CH3:5])[OH:46])[O:52]1

Parent-child relations graph

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