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TACALCITOL

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Name: TACALCITOL
CAS: 57333-96-7
Synonyms: (1R,3S,Z)-5-((E)-2-((1R,3AS,7AR)-1-((2R,5R)-5,6-DIMETHYLHEPTAN-2-YL)-7A-METHYLHEXAHYDRO-1H-INDEN-4(2H)-YLIDENE)ETHYLIDENE)-4-METHYLENECYCLOHEXANE-1,3-DIOL ; (1A,3B,5Z,7E,24R)-9,10-SECOCHOLESTA-5,7,10(19)-TRIENE-1,3,24-TRIOL ; 1ALPHA,24R-DIHYDROXYVITAMIN D3 ; (1ALPHA,3BETA,5Z,7E,24R)-9,10-SECOCHOLESTA-5,7,10(19)-TRIENE-1,3,24-TRIOL ; 1,24(R)-DIHYDROXYVITAMIN D3 ; TACALCITOL
MDL.: MFCD00866623
H bond acceptor: 3
H bond donor: 3
Smile: CC(C)[C@@H](CC[C@@H](C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C)O
InChi: InChI=1S/C27H44O3/c1-17(2)25(29)13-8-18(3)23-11-12-24-20(7-6-14-27(23,24)5)9-10-21-15-22(28)16-26(30)19(21)4/h9-10,17-18,22-26,28-30H,4,6-8,11-16H2,1-3,5H3/b20-9+,21-10-/t18-,22-,23-,24+,25-,26+,27-/m1/s1
InChiKey: InChIKey=BJYLYJCXYAMOFT-RSFVBTMBSA-N

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