Catalog Number:
AG009EAU
Chemical Name:
4-Hydroxy Cholesterol-d7
CAS Number:
1246302-80-6
Molecular Formula:
C27H39D7O2
Molecular Weight:
409.6961
MDL Number:
MFCD15071187
IUPAC Name:
(3S,4R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,4-diol
InChI:
InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)20-11-12-21-19-9-10-23-25(29)24(28)14-16-27(23,5)22(19)13-15-26(20,21)4/h10,17-22,24-25,28-29H,6-9,11-16H2,1-5H3/t18-,19+,20-,21+,22+,24+,25-,26-,27-/m1/s1/i1D3,2D3,17D
InChI Key:
CZDKQKOAHAICSF-BZNWTYAPSA-N
SMILES:
C[C@@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H]([C@@H]2O)O)CCCC(C([2H])([2H])[2H])(C([2H])([2H])[2H])[2H]
