CAS: 362-66-3 - S-stearoylcoenzyme A

Formula: C₃₉H₇₀N₇O₁₇P₃S

InChI: InChI=1S/C39H70N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(48)67-23-22-41-29(47)20-21-42-37(51)34(50)39(2,3)25-60-66(57,58)63-65(55,56)59-24-28-33(62-64(52,53)54)32(49)38(61-28)46-27-45-31-35(40)43-26-44-36(31)46/h26-28,32-34,38,49-50H,4-25H2,1-3H3,(H,41,47)(H,42,51)(H,55,56)(H,57,58)(H2,40,43,44)(H2,52,53,54)/t28-,32-,33-,34+,38-/m1/s1

InChI key: InChIKey=SIARJEKBADXQJG-LFZQUHGESA-N

SMILES: O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(N2C=NC=3C(=NC=NC32)N)C(O)C1OP(=O)(O)O)CCCCCCCCCCCCCCCCC

Synonyms:

• Coenzyme A, S-octadecanoate
• Coenzyme A, S-stearate
• Octadecanoyl-CoA
• Octadecanoyl-coenzyme A
• S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} octadecanethioate (non-preferred name)
• S-{1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} octadecanethioate (non-preferred name)
• S-{1-[5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} octadecanethioate (non-preferred name)
• Stearoyl coenzyme A ester
• Stearoyl-CoA
• Stearoyl-coenzyme A
• Stearyl coenzyme A
• Stearyl-CoA

Octadecanoyl Coenzyme A K salt

CAS: 362-66-3

• Formula: C39H70N7O17P3S
• Purity: >95%
• Color and Shape: Solid
• Molecular weight: 1034

Stearoyl coenzyme A free acid hydrate

CAS: 362-66-3

Stearoyl coenzyme A free acid hydrate is a natural, non-synthetic lipid molecule that belongs to …

• Formula: C₃₉H₇₀N₇O₁₇P₃S•H₂O
• Purity: Min. 92 Area-%
• Color and Shape: White Powder
• Molecular weight: 1,052.01 g/mol