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Basic Information |
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Product Name: | INECALCITOL |
CAS: | 163217-09-2 |
English Synonyms: | (7E)-19-NOR-9,10-SECO-14BETA-CHOLESTA-5,7-DIEN-23-YNE-1ALPHA,3BETA,25-TRIOL ; INECALCITOL |
MDL Number.: | MFCD09838524 |
H bond acceptor: | 3 |
H bond donor: | 3 |
Smile: | C[C@H](CC#CC(C)(C)O)[C@H]1CC[C@H]\2[C@@]1(CCC/C2=C\C=C3C[C@H](C[C@@H](C3)O)O)C |
InChi: | InChI=1S/C26H40O3/c1-18(7-5-13-25(2,3)29)23-11-12-24-20(8-6-14-26(23,24)4)10-9-19-15-21(27)17-22(28)16-19/h9-10,18,21-24,27-29H,6-8,11-12,14-17H2,1-4H3/b20-10+/t18-,21-,22-,23-,24-,26-/m1/s1 |
InChiKey: | InChIKey=HHGRMHMXKPQNGF-WNSNRMDMSA-N |
* If the product has intellectual property rights, a license granted is must or contact us.