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7-Dehydrocholesterol(434-16-2) 13C NMR
Product Name7-Dehydrocholesterol
CAS434-16-2
Molecular FormulaC27H44O
Molecular Weight384.64
InChIInChI=1/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9-10,18-19,21,23-25,28H,6-8,11-17H2,1-5H3/t19-,21+,23-,24+,25+,26+,27-/s3
InChIKey UCTLRSWJYQTBFZ-PDTMYDHWNA-N
Smiles[C@]12([C@](C)(CC[C@]3([H])[C@@]4(C)CC[C@H](O)CC4=CC=C13)[C@H](CC2)[C@H](C)CCCC(C)C)[H] |&1:0,1,5,7,11,18,21,r|
