Concept information
Preferred term
PKDdiA PG
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C34H61O13P
inchi
- InChI=1S/C34H61O13P/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-21-33(40)44-27-31(28-46-48(42,43)45-26-30(37)25-35)47-34(41)22-19-16-13-14-17-20-29(36)23-24-32(38)39/h23-24,30-31,35,37H,2-22,25-28H2,1H3,(H,38,39)(H,42,43)/b24-23+/t30-,31+/m0/s1
inchikey
- KRELQGFNCRRAOK-HKBYNSHSSA-N
mass
- 708.823
monoisotopicmass
- 708.38498
smiles
- P(OC[C@H](OC(=O)CCCCCCCC(=O)/C=C/C(O)=O)COC(=O)CCCCCCCCCCCCCCC)(OC[C@@H](O)CO)(O)=O
subset
- 2_STAR
synonym EXACT
- (E)-12-[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-hexadecanoyloxypropan-2-yl]oxy-4,12-dioxododec-2-enoic acid
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:185690
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