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11-(4-acetoxymethylphenyl)-1alpha,25-dihydroxy-9,11-didehydrovitamin D3 / 11-(4-acetoxymethylphenyl)-1alpha,25-dihydroxy-9,11-didehydrocholecalciferol

PropertiesImageOccurences in reactions
MNX_IDMNXM33094Image of MNXM33094
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC36H50O5
charge0
mass562.36582
referencelipidmapsM:LMST03020539
InChIKeySNTZJXQDBRAJSJ-QKZVOMOWSA-N
InChIInChI=1S/C36H50O5/c1-23(8-7-17-35(4,5)40)32-15-16-33-29(14-13-28-19-31(38)20-34(39)24(28)2)18-30(21-36(32,33)6)27-11-9-26(10-12-27)22-41-25(3)37/h9-14,18,23,31-34,38-40H,2,7-8,15-17,19-22H2,1,3-6H3/b28-13-,29-14+/t23-,31-,32-,33+,34+,36-/m1/s1
SMILESC=C1/C(=C\C=C2/C=C(c3ccc(COC(C)=O)cc3)C[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CCCC(C)(C)O)C[C@@H](O)C[C@@H]1O
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Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMST03020539
lipidmapsM:LMST03020539 		11-(4-acetoxymethylphenyl)-1alpha,25-dihydroxy-9,11-didehydrovitamin D3 / 11-(4-acetoxymethylphenyl)-1alpha,25-dihydroxy-9,11-didehydrocholecalciferol
(5Z,7E)-(1S,3R)-11-(4-acetoxymethylphenyl)-9,10-seco-5,7,9(11),10(19)-cholestatetraene-1,3,25-triol