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70240-78-7 | 3 beta-methoxy-6-beta-iodomethyl-19-norcholest-5(10)ene
CAS No: 70240-78-7 Catalog No: AG00FKC2 MDL No:
Product Description
Catalog Number:
AG00FKC2
Chemical Name:
3 beta-methoxy-6-beta-iodomethyl-19-norcholest-5(10)ene
CAS Number:
70240-78-7
IUPAC Name:
(3S,6R,8S,9S,13R,14S,17R)-6-(iodomethyl)-3-methoxy-13-methyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene
InChI:
InChI=1S/C28H47IO/c1-18(2)7-6-8-19(3)26-11-12-27-25-15-20(17-29)24-16-21(30-5)9-10-22(24)23(25)13-14-28(26,27)4/h18-21,23,25-27H,6-17H2,1-5H3/t19-,20+,21+,23-,25-,26-,27+,28-/m1/s1
InChI Key:
LLHJJPFLHKMELY-HJWFFQFZSA-N
Properties
Complexity:
624
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
8
Defined Bond Stereocenter Count:
0
Exact Mass:
526.267g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
526.587g/mol
Monoisotopic Mass:
526.267g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.4
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