a 24-epicathasterone sulfate

Properties Image MNX_ID MNXM1133849 reference metacycM:24-Epicathasterone-Sulfates formula C28H46O3*2 global charge 0 mol weight   InChIKey   InChI   SMILES [*]O[C@H]1CC[C@@]2(C)[C@H](C1)C(=O)C[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)[C@H](C[C@H](C)C(C)C)O[*])CC[C@@H]12 MNX internals InChI (mnx) InChI=1/C30H52O3/c1-18(2)19(3)15-28(33-8)20(4)23-9-10-24-22-17-27(31)26-16-21(32-7)11-13-30(26,6)25(22)12-14-29(23,24)5/h18-26,28H,9-17H2,1-8H3/t19-,20-,21-,22-,23+,24-,25-,26+,28-,29+,30+/m0/s1/i7+1,8+1 SMILES (mnx) [CH3:1][CH:18]([CH3:2])[C@@H:19]([CH3:3])[CH2:15][C@@H:28]([C@@H:20]([CH3:4])[C@H:23]1[CH2:9][CH2:10][C@H:24]2[C@@H:22]3[CH2:17][C:27](=[O:31])[C@H:26]4[CH2:16][C@@H:21]([O:32][13CH3:7])[CH2:11][CH2:13][C@:30]4([CH3:6])[C@H:25]3[CH2:12][CH2:14][C@:29]12[CH3:5])[O:33][13CH3:8]

Parent-child relations graph

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