Analyte Name

Zymosterol-2,2,3,4,4-D5

CAS Number

1246298-29-2

Molecular Formula

C27 D5 H39 O

Molecular Weight

389.668

Accurate Mass

389.371

SMILES

[2H]C1([2H])C[C@@]2(C)[C@@H](CCC3=C2CC[C@]4(C)[C@H](CC[C@@H]34)[C@H](C)CCC=C(C)C)C([2H])([2H])[C@@]1([2H])O

InChI

InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,19-21,23-24,28H,6,8-17H2,1-5H3/t19-,20+,21+,23-,24+,26+,27-/m1/s1/i13D2,17D2,21D

IUPAC

(3S,5S,10S,13R,14R,17R)-2,2,3,4,4-pentadeuterio-10,13-dimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-1,5,6,7,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-ol

Unlabelled CAS Number

128-33-6

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat