[(2R,3S,5S,6S)-4-[(2-butanoyloxy-3-octadecanoyloxy-propoxy)-hydroxy-phosphoryl]oxy-3,5-dihydroxy-2,6-diphosphonooxy-cyclohexyl]oxyphosphonic acid
Molecular Formula:
C31H62O22P4
InChI: InChI=1/C31H62O22P4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-24(32)47-21-23(49-25(33)19-4-2)22-48-57(45,46)53-28-26(34)29(50-54(36,37)38)31(52-56(42,43)44)30(27(28)35)51-55(39,40)41/h23,26-31,34-35H,3-22H2,1-2H3,(H,45,46)(H2,36,37,38)(H2,39,40,41)(H2,42,43,44)/t23?,26-,27-,28?,29-,30+,31?/m0/s1/f/h36-37,39-40,42-43,45H
InChIKey: InChIKey=JUTZSKVZRRCGCI-FTSUJTIJDI
SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC1C(C(C(C(C1O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)O)OC(=O)CCC
Names:
[(2R,3S,5S,6S)-4-[(2-butanoyloxy-3-octadecanoyloxy-propoxy)-hydroxy-phosphoryl]oxy-3,5-dihydroxy-2,6-diphosphonooxy-cyclohexyl]oxyphosphonic acid
Registries:
PubChem CID 10350791
PubChem ID 15362265
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