Marvin  08290813592D          

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  6 29  1  1  0  0  0
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M  END
> <ID>
CHEBI:20265

> <NAME>
lanostane

> <STAR>
3

> <SYNONYM>
[5S-[5alpha,8beta,9alpha,10beta,13beta,14alpha,17beta(S*)]]-17-(1,5-dimethylhexyl)hexadecahydro-4,4,10,13,14-pentamethyl-1H-cyclopenta[a]phenanthrene; 4,4,14-trimethylcholestane; (5alpha)-4,4,14-trimethylcholestane

> <IUPAC_NAME>
lanostane

> <FORMULA>
C30H54

> <MASS>
414.74976

> <MONOISOTOPIC_MASS>
414.42255

> <CHARGE>
0

> <SMILES>
[H][C@@]1(CC[C@@]2(C)[C@]3([H])CC[C@@]4([H])C(C)(C)CCC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C

> <INCHI>
InChI=1S/C30H54/c1-21(2)11-9-12-22(3)23-15-19-30(8)25-13-14-26-27(4,5)17-10-18-28(26,6)24(25)16-20-29(23,30)7/h21-26H,9-20H2,1-8H3/t22-,23-,24+,25-,26+,28-,29-,30+/m1/s1

> <INCHIKEY>
ZQIOPEXWVBIZAV-ZKYCIREVSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
3137145

> <CAS_REGISTRY_NUMBER>
474-20-4

> <CHEMIDPLUS>
474-20-4

> <NIST_CHEMISTRY_WEBBOOK>
474-20-4

$$$$