Concept information
Preferred term
18 CoA 18 oxo dinor LTB4
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C39H60N7O21P3S
inchi
- InChI=1S/C39H60N7O21P3S/c1-39(2,22-64-70(61,62)67-69(59,60)63-21-27-33(66-68(56,57)58)32(53)38(65-27)46-24-45-31-35(40)43-23-44-36(31)46)34(54)37(55)42-18-17-28(49)41-19-20-71-30(52)16-9-5-8-13-25(47)11-6-3-4-7-12-26(48)14-10-15-29(50)51/h3-8,11-12,23-27,32-34,38,47-48,53-54H,9-10,13-22H2,1-2H3,(H,41,49)(H,42,55)(H,50,51)(H,59,60)(H,61,62)(H2,40,43,44)(H2,56,57,58)
inchikey
- CQLBXHGTJMWNLT-UHFFFAOYSA-N
mass
- 1087.920
monoisotopicmass
- 1087.27758
smiles
- S(CCNC(=O)CCNC(=O)C(O)C(COP(OP(OCC1OC(N2C3=NC=NC(N)=C3N=C2)C(O)C1OP(O)(O)=O)(O)=O)(O)=O)(C)C)C(=O)CCC=CCC(O)C=CC=CC=CC(O)CCCC(O)=O
subset
- 2_STAR
synonym EXACT
- 18-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulanyl]-5,12-dihydroxy-18-oxooctadeca-6,8,10,14-tetraenoic acid
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:173306
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