Concept information
Preferred term
(E) 2 benzylidenesuccinyl CoA
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
alt_id
- CHEBI:10948
- CHEBI:21124
- CHEBI:4731
charge
- 0
formula
- C32H44N7O19P3S
inchi
- InChI=1S/C32H44N7O19P3S/c1-32(2,26(44)29(45)35-9-8-21(40)34-10-11-62-31(46)19(13-22(41)42)12-18-6-4-3-5-7-18)15-55-61(52,53)58-60(50,51)54-14-20-25(57-59(47,48)49)24(43)30(56-20)39-17-38-23-27(33)36-16-37-28(23)39/h3-7,12,16-17,20,24-26,30,43-44H,8-11,13-15H2,1-2H3,(H,34,40)(H,35,45)(H,41,42)(H,50,51)(H,52,53)(H2,33,36,37)(H2,47,48,49)/b19-12+/t20-,24-,25-,26+,30-/m1/s1
inchikey
- CIZCKPNGZPENDV-RUCZCKOISA-N
is_conjugate_acid_of
mass
- 955.71482
monoisotopicmass
- 955.16255
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)C(/CC(O)=O)=C/c1ccccc1
subset
- 3_STAR
synonym EXACT
- 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2E)-2-(carboxymethyl)-3-phenylprop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
- (E)-2-Benzylidenesuccinyl-CoA
synonym RELATED
- (E)-2-benzylidenesuccinyl-coenzyme A
- E-Phenylitaconyl-CoA
- (trans)-2-benzylidenesuccinyl-CoA
- (trans)-2-benzylidenesuccinyl-coenzyme A
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:27639
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