require_once( "../navigation.include" ); ?>
check_image( "../cid_images/cid_445344.png" ); ?>
check_image( "../cid_thumbs/cid_441263.png" ); ?>
check_image( "../cid_thumbs/cid_441253.png" ); ?>
check_image( "../cid_thumbs/cid_441146.png" ); ?>
check_image( "../cid_thumbs/cid_440870.png" ); ?>
check_image( "../cid_thumbs/cid_5280766.png" ); ?>
check_image( "../cid_thumbs/cid_440609.png" ); ?>
check_image( "../cid_thumbs/cid_440603.png" ); ?>
check_image( "../cid_thumbs/cid_440602.png" ); ?>
check_image( "../cid_thumbs/cid_440600.png" ); ?>
check_image( "../cid_thumbs/cid_440295.png" ); ?>
check_image( "../cid_thumbs/cid_440205.png" ); ?>
check_image( "../cid_thumbs/cid_439989.png" ); ?>
check_image( "../cid_thumbs/cid_439892.png" ); ?>
check_image( "../cid_thumbs/cid_439598.png" ); ?>
check_image( "../cid_thumbs/cid_11953787.png" ); ?>
check_image( "../cid_thumbs/cid_439320.png" ); ?>
check_image( "../cid_thumbs/cid_439266.png" ); ?>
check_image( "../cid_thumbs/cid_986.png" ); ?>
check_image( "../cid_thumbs/cid_714.png" ); ?>
check_image( "../cid_thumbs/cid_365.png" ); ?>
check_image( "../cid_thumbs/cid_265.png" ); ?>
check_image( "../cid_thumbs/cid_181.png" ); ?>
pre_formula_key( "InChIKey=KQMZYOXOBSXMII-WXBBAMDSDG", "jqp019/445344.html" ); ?>
pre_formula( "InChI=1/C29H50N7O17P3S/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36/h16-18,22-24,28,39-40H,4-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/t18-,22-,23-,24+,28-/m1/s1/f/h31-32,42-43,45,47H,30H2", "jqp019/445344.html" ); ?>
Molecular Formula:
C29H50N7O17P3S
InChI: InChI=1/C29H50N7O17P3S/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36/h16-18,22-24,28,39-40H,4-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/t18-,22-,23-,24+,28-/m1/s1/f/h31-32,42-43,45,47H,30H2
InChIKey: InChIKey=KQMZYOXOBSXMII-WXBBAMDSDG
SMILES: CCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n2cnc3c(N)ncnc23
CAS number 1264-52-4
Names:
Coenzyme A, S-octanoate
Octanoyl-CoA
octanoyl-CoA
Octanoyl-CoA
Octanoyl-coa
octanoyl-CoA
Octanoyl-coenzyme A
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-2,2-dimethyl-3-[2-(2-octanoylsulfanylethylcarbamoyl)ethylcarbamoyl]propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid
name_it( "InChI=1/C29H50N7O17P3S/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36/h16-18,22-24,28,39-40H,4-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/t18-,22-,23-,24+,28-/m1/s1/f/h31-32,42-43,45,47H,30H2", "jqp019/445344.html" ); ?>
Registries:
pre_registry_key( "InChI=1/C29H50N7O17P3S/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36/h16-18,22-24,28,39-40H,4-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/t18-,22-,23-,24+,28-/m1/s1/f/h31-32,42-43,45,47H,30H2", "InChIKey=KQMZYOXOBSXMII-WXBBAMDSDG", "jqp019/445344.html" ); ?>
PubChem CID 445344
Beilstein =6562085
CAS 1264-52-4 (from NIST)
ChEBI 15533
Kegg C01944
PubChem ID 10299678
PubChem ID 5048
UM-BBD c0048
pre_ads_key( "InChIKey=KQMZYOXOBSXMII-WXBBAMDSDG", "jqp019/445344.html" ); ?>
pre_ads( "InChI=1/C29H50N7O17P3S/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36/h16-18,22-24,28,39-40H,4-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/t18-,22-,23-,24+,28-/m1/s1/f/h31-32,42-43,45,47H,30H2", "jqp019/445344.html" ); ?>
require_once( "../ads.include" ); ?>
pre_related( "InChI=1/C29H50N7O17P3S/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36/h16-18,22-24,28,39-40H,4-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/t18-,22-,23-,24+,28-/m1/s1/f/h31-32,42-43,45,47H,30H2", "jqp019/445344.html" ); ?>