Concept information
Preferred term
(3S) 3 ایزوپروپنیل 6 oxoheptanoyl CoA
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C31H50N7O18P3S
has_functional_parent
has_role
inchi
- InChI=1S/C31H50N7O18P3S/c1-17(2)19(7-6-18(3)39)12-22(41)60-11-10-33-21(40)8-9-34-29(44)26(43)31(4,5)14-53-59(50,51)56-58(48,49)52-13-20-25(55-57(45,46)47)24(42)30(54-20)38-16-37-23-27(32)35-15-36-28(23)38/h15-16,19-20,24-26,30,42-43H,1,6-14H2,2-5H3,(H,33,40)(H,34,44)(H,48,49)(H,50,51)(H2,32,35,36)(H2,45,46,47)/t19-,20+,24+,25+,26-,30+/m0/s1
inchikey
- VMTHAXKUEKKCEY-PNPVFPMQSA-N
mass
- 933.75236
monoisotopicmass
- 933.21459
smiles
- CC(=O)CC[C@@H](CC(=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)n1cnc2c(N)ncnc12)C(C)=C
subset
- 3_STAR
synonym EXACT
- 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(3S)-6-oxo-3-(prop-1-en-2-yl)heptanoyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}
- (3S)-3-Isopropenyl-6-oxoheptanoyl-CoA
synonym RELATED
- (3S)-3-isopropenyl-6-oxoenanthoyl-CoA
- (3S)-3-isopropenyl-6-oxoenanthoyl-coenzyme A
- (3S)-3-isopropenyl-6-oxoheptanoyl-coenzyme A
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:212
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