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FALECALCITRIOL

FALECALCITRIOL

Name: FALECALCITRIOL

CAS: 83805-11-2

Formula: C27 H38 F6 O3

Weight: 524.582

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Name： FALECALCITRIOL
CAS： 83805-11-2
Synonyms： FALECALCITRIOL ; (1R,3S,5Z)-5-[(2E)-2-[(1R,3AS,7AR)-7A-METHYL-1-[(2R)-7,7,7-TRIFLUORO-6-HYDROXY-6-(TRIFLUOROMETHYL)HEPTAN-2-YL]-2,3,3A,5,6,7-HEXAHYDRO-1H-INDEN-4-YLIDENE]ETHYLIDENE]-4-METHYLIDENECYCLOHEXANE-1,3-DIOL ; HORNEL
MDL.： MFCD00870595
H bond acceptor： 3
H bond donor： 3
Smile： C[C@H](CCCC(C(F)(F)F)(C(F)(F)F)O)[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
InChi： InChI=1S/C27H38F6O3/c1-16(6-4-13-25(36,26(28,29)30)27(31,32)33)21-10-11-22-18(7-5-12-24(21,22)3)8-9-19-14-20(34)15-23(35)17(19)2/h8-9,16,20-23,34-36H,2,4-7,10-15H2,1,3H3/b18-8+,19-9-/t16-,20-,21-,22+,23+,24-/m1/s1
InChiKey： InChIKey=XPYGGHVSFMUHLH-UUSULHAXSA-N

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