Concept information
Preferred term
1,4-dihydroxy-2-naphthoyl-coa
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C32H42N7O19P3S
has_functional_parent
has_role
inchi
- InChI=1S/C32H42N7O19P3S/c1-32(2,26(44)29(45)35-8-7-21(41)34-9-10-62-31(46)18-11-19(40)16-5-3-4-6-17(16)23(18)42)13-55-61(52,53)58-60(50,51)54-12-20-25(57-59(47,48)49)24(43)30(56-20)39-15-38-22-27(33)36-14-37-28(22)39/h3-6,11,14-15,20,24-26,30,40,42-44H,7-10,12-13H2,1-2H3,(H,34,41)(H,35,45)(H,50,51)(H,52,53)(H2,33,36,37)(H2,47,48,49)/t20-,24-,25-,26+,30-/m1/s1
inchikey
- PYTINLGPKDJURZ-HSJNEKGZSA-N
is_conjugate_acid_of
mass
- 953.69800
monoisotopicmass
- 953.14690
smiles
- CC(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@@H](O)C(=O)NCCC(=O)NCCSC(=O)c1cc(O)c2ccccc2c1O
subset
- 3_STAR
synonym EXACT
- 1,4-Dihydroxy-2-naphthoyl-CoA
- 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(1,4-dihydroxy-2-naphthoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
synonym RELATED
- 1,4-dihydroxy-2-naphthoyl-coenzyme A
- DHNA-CoA
In other languages
-
Persian
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:52668
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