5737-19-9
20-METHYL-5ALPHA(H)-PREGNANE
Name20-METHYL-5ALPHA(H)-PREGNANE
1Identification
【Name】
20-METHYL-5ALPHA(H)-PREGNANE
【CAS】
【MDL】
MFCD00216267
【English Synonyms】
【Formula】
C22 H38
【MolWeight】
302.542
【Inchi】
InChI=1S/C22H38/c1-15(2)18-10-11-19-17-9-8-16-7-5-6-13-21(16,3)20(17)12-14-22(18,19)4/h15-20H,5-14H2,1-4H3/t16-,17+,18-,19+,20+,21+,22-/m1/s1
【InChIKey】
InChIKey=NWNSDNWCYSYUMD-MVSFUWRLSA-N
【SMILES】
CC(C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCC4)C)C
【MOL File】
20-METHYL-5ALPHA(H)-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
20-METHYL-5ALPHA(H)-PREGNANE.cml