2-hydroxyisobutanoyl-CoA
chemical compound
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2-hydroxyisobutanoyl-CoA
Summary
2-hydroxyisobutanoyl-CoA is a group of stereoisomers[1].
Key Facts
- 2-hydroxyisobutanoyl-CoA's instance of is recorded as group of stereoisomers[2].
- 2-hydroxyisobutanoyl-CoA's canonical SMILES is recorded as CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)C(C)(C)O)O[3].
- 2-hydroxyisobutanoyl-CoA's InChI is recorded as InChI=1S/C25H42N7O18P3S/c1-24(2,18(35)21(36)28-6-5-14(33)27-7-8-54-23(37)25(3,4)38)10-47-53(44,45)50-52(42,43)46-9-13-17(49-51(39,40)41)16(34)22(48-13)32-12-31-15-19(26)29-11-30-20(15)32/h11-13,16-18,22,34-35,38H,5-10H2,1-4H3,(H,27,33)(H,28,36)(H,42,43)(H,44,45)(H2,26,29,30)(H2,39,40,41)/t13-,16-,17-,18+,22-/m1/s1[4].
- 2-hydroxyisobutanoyl-CoA's InChIKey is recorded as FFVUICCDNWZCRC-ZSJPKINUSA-N[5].
- 2-hydroxyisobutanoyl-CoA's chemical formula is recorded as C₂₅H₄₂N₇O₁₈P₃S[6].
- 2-hydroxyisobutanoyl-CoA's subclass of is recorded as chemical compound[7].
- 2-hydroxyisobutanoyl-CoA's PDB structure ID is recorded as 4R3U[8].
- 2-hydroxyisobutanoyl-CoA's ChemSpider ID is recorded as 35035202[9].
- 2-hydroxyisobutanoyl-CoA's PubChem CID is recorded as 87068711[10].
- 2-hydroxyisobutanoyl-CoA's ChEBI ID is recorded as 132116[11].
- 2-hydroxyisobutanoyl-CoA's Reaxys registry number is recorded as 22539664[12].
- 2-hydroxyisobutanoyl-CoA's isomeric SMILES is recorded as CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1C@HOP(=O)(O)O)C@HOC@HOP(=O)(O)O)C@HO">[13].
- 2-hydroxyisobutanoyl-CoA's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+853.152'}[14].
- 2-hydroxyisobutanoyl-CoA's SureChEMBL ID is recorded as 119813[15].
- 2-hydroxyisobutanoyl-CoA's DSSTox substance ID is recorded as DTXSID601046752[16].
- 2-hydroxyisobutanoyl-CoA's PDB ligand ID is recorded as 3KK[17].
- 2-hydroxyisobutanoyl-CoA's UniChem compound ID is recorded as 78333158[18].