CAS: 119785-99-8 - Coenzyme A, S-[(2E)-3-(4-hydroxyphenyl)-2-propenoate]

Formula: C₃₀H₄₂N₇O₁₈P₃S

InChI: InChI=1S/C30H42N7O18P3S/c1-30(2,25(42)28(43)33-10-9-20(39)32-11-12-59-21(40)8-5-17-3-6-18(38)7-4-17)14-52-58(49,50)55-57(47,48)51-13-19-24(54-56(44,45)46)23(41)29(53-19)37-16-36-22-26(31)34-15-35-27(22)37/h3-8,15-16,19,23-25,29,38,41-42H,9-14H2,1-2H3,(H,32,39)(H,33,43)(H,47,48)(H,49,50)(H2,31,34,35)(H2,44,45,46)/b8-5+/t19-,23-,24-,25+,29-/m1/s1

InChI key: InChIKey=DMZOKBALNZWDKI-MATMFAIHSA-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)C=CC4=CC=C(O)C=C4

Synonyms:

• S-{(9R)-17-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-9,13,15-trihydroxy-10,10-dimethyl-13,15-dioxido-4,8-dioxo-12,14,16-trioxa-3,7-diaza-13,15-diphosphaheptadec-1-yl} (2E)-3-(4-hydroxyphenyl)prop-2-enethioate (non-preferred name)
• 4-coumaroyl-coenzyme A
• S-{17-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-9,13,15-trihydroxy-10,10-dimethyl-13,15-dioxido-4,8-dioxo-12,14,16-trioxa-3,7-diaza-13,15-diphosphaheptadec-1-yl} (2E)-3-(4-hydroxyphenyl)prop-2-enethioate (non-preferred name)
• p-coumaroyl-CoA
• (E)-p-Coumaroyl-CoA
• Coenzyme A, S-[3-(4-hydroxyphenyl)-2-propenoate], (E)-
• Coenzyme A, S-[(2E)-3-(4-hydroxyphenyl)-2-propenoate]

(E)-S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) 3-(4-hydroxyphenyl)prop-2-enethioate

CAS: 119785-99-8

• Formula: C30H42N7O18P3S
• Purity: 95%
• Molecular weight: 913.68

[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[3-hydroxy-3-[2-[2-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]sulfanylethylcarbamoyl]ethylcarbamoyl]-2,2-dimethyl-propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid

CAS: 119785-99-8

• Formula: C₃₀H₄₂N₇O₁₈P₃S
• Purity: 95%
• Color and Shape: Solid
• Molecular weight: 913.6769

p-Coumaryl-coenzyme A

CAS: 119785-99-8

Please enquire for more information about p-Coumaryl-coenzyme A including the price, delivery time and more …

• Formula: C₃₀H₄₂N₇O₁₈P₃S
• Purity: Min. 95%
• Color and Shape: Powder
• Molecular weight: 913.68 g/mol

(E)-p-Coumaroyl-CoA

CAS: 119785-99-8

• Formula: C₃₀H₄₂N₇O₁₈P₃S
• Color and Shape: Neat
• Molecular weight: 913.677