RefMet Compound Details
MW structure | 36211 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | 1-Hydroxyvitamin D3 3-D-glucopyranoside | |
Systematic name | (5Z,7E)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatrien-3-D-glucopyranoside | |
SMILES | CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@H](C[C@@H](C3=C)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@@H](C(=O)O)O3)O)O)O)/CCC[C@]12C Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 576.366220 (neutral) |