InChI=1S/C48H78N7O20P3S/c1- 25(29- 8- 9- 30- 36- 31(12- 15- 48(29,30) 6) 47(5) 14- 11- 28(56) 19- 27(47) 20- 33(36) 58) 7- 10- 32(57) 26(2) 45(63) 79- 18- 17- 50- 35(59) 13- 16- 51- 43(62) 40(61) 46(3,4) 22- 72- 78(69,70) 75- 77(67,68) 71- 21- 34- 39(74- 76(64,65) 66) 38(60) 44(73- 34) 55- 24- 54- 37- 41(49) 52- 23- 53- 42(37) 55/h23- 31,33- 34,36,38- 40,44,56,58,60- 61H,7- 22H2,1- 6H3,(H,50,59) (H,51,62) (H,67,68) (H,69,70) (H2,49,52,53) (H2,64,65,66) /t25- ,26?,27+,28- ,29- ,30+,31+,33- ,34- ,36+,38- ,39- ,40+,44- ,47+,48- /m1/s1 |
QWTJBRPOHKIMDT-MVFHLHSISA-N |
[H] [C@@] (C) (CCC(=O) C(C) C(=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@@] 1([H] ) CC[C@@] 2([H] ) [C@] 3([H] ) [C@H] (O) C[C@] 4([H] ) C[C@H] (O) CC[C@] 4(C) [C@@] 3([H] ) CC[C@] 12C |
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Mus musculus
(NCBI:txid10090)
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Source: BioModels - MODEL1507180067
See:
PubMed
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Homo sapiens
(NCBI:txid9606)
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See:
PubMed
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acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
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mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
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View more via ChEBI Ontology
Outgoing
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3α,7α-dihydroxy-24-oxo-5β-cholestan-26-oyl-CoA
(CHEBI:28533)
has role
human metabolite
(CHEBI:77746)
3α,7α-dihydroxy-24-oxo-5β-cholestan-26-oyl-CoA
(CHEBI:28533)
has role
mouse metabolite
(CHEBI:75771)
3α,7α-dihydroxy-24-oxo-5β-cholestan-26-oyl-CoA
(CHEBI:28533)
is a
cholestanoyl-CoA
(CHEBI:23197)
3α,7α-dihydroxy-24-oxo-5β-cholestan-26-oyl-CoA
(CHEBI:28533)
is conjugate acid of
3α,7α-dihydroxy-24-oxo-5β-cholestan-26-oyl-CoA(4−)
(CHEBI:87704)
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Incoming
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3α,7α-dihydroxy-24-oxo-5β-cholestan-26-oyl-CoA(4−)
(CHEBI:87704)
is conjugate base of
3α,7α-dihydroxy-24-oxo-5β-cholestan-26-oyl-CoA
(CHEBI:28533)
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3'- phosphoadenosine 5'- {3- [(3R)- 4- {[3- ({2- [(3α,7α- dihydroxy- 24- oxo- 5β- cholestan- 26- oyl)sulfanyl]ethyl}amino)- 3- oxopropyl]amino}- 3- hydroxy- 2,2- dimethyl- 4- oxobutyl] dihydrogen diphosphate}
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3α,7α-dihydroxy-24-oxo-5β-cholestan-26-oyl-coenzyme A
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ChEBI
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3alpha,7alpha-Dihydroxy-5beta-24-oxocholestanoyl-CoA
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KEGG COMPOUND
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11146090
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PubMed citation
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Europe PMC
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