33281-23-1
17ALPHA(H),21ALPHA(H)-HOPANE
Name17ALPHA(H),21ALPHA(H)-HOPANE
1Identification
【Name】
17ALPHA(H),21ALPHA(H)-HOPANE
【CAS】
【MDL】
MFCD02683723
【English Synonyms】
【Formula】
C30 H52
【MolWeight】
412.741
【Inchi】
InChI=1S/C30H52/c1-20(2)21-12-17-27(5)22(21)13-18-29(7)24(27)10-11-25-28(6)16-9-15-26(3,4)23(28)14-19-30(25,29)8/h20-25H,9-19H2,1-8H3/t21-,22+,23-,24+,25+,27-,28-,29+,30+/m0/s1
【InChIKey】
InChIKey=ZRLNBWWGLOPJIC-VMWSQYRBSA-N
【SMILES】
CC(C)[C@@H]1CC[C@]2([C@@H]1CC[C@@]3([C@@H]2CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCCC5(C)C)C)C)C)C
【MOL File】
17ALPHA(H),21ALPHA(H….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:10.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
17ALPHA(H),21ALPHA(H)-HOPANE.cml