Previtamin D2 (~90%)

Product Specifications

CAS Number

21307-05-1

Hazard Statement

Toxic if swallowed; UN number: UN2811; Packing Group: II

Smiles

CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C(=CCC[C@]12C)\C=C\C3=C(C)CC[C@@H](O)C3

Molecular Formula

C28 H44 O

Molecular Weight

396.65

InChI

InChI=1S/C28H44O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h8-10,12-13,19-20,22,25-27,29H,7,11,14-18H2,1-6H3/b10-9+,13-12+/t20-,22+,25+,26+,27-,28+/m0/s1

Additionnal Information

IUPAC name: (1R)-3-[(E)-2-[(1R,3aR,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-ol