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125305-73-9 | 9,19-Cyclolanostane-3,25-diol, 21,24-epoxy-, (3β,24R)- (9CI)
CAS No: 125305-73-9 Catalog No: AG000NGS MDL No:MFCD22417316
Product Description
Catalog Number:
AG000NGS
Chemical Name:
9,19-Cyclolanostane-3,25-diol, 21,24-epoxy-, (3β,24R)- (9CI)
CAS Number:
125305-73-9
MDL Number:
MFCD22417316
IUPAC Name:
(1S,3R,6S,8R,11S,12S,15R,16R)-15-[(3R,6R)-6-(2-hydroxypropan-2-yl)oxan-3-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
InChI:
InChI=1S/C30H50O3/c1-25(2)21-8-9-22-28(6)13-11-20(19-7-10-24(33-17-19)26(3,4)32)27(28,5)15-16-30(22)18-29(21,30)14-12-23(25)31/h19-24,31-32H,7-18H2,1-6H3/t19-,20+,21-,22-,23-,24+,27+,28-,29+,30-/m0/s1
InChI Key:
LFVUQOXYVCRDLE-BCFAIRCFSA-N
Properties
Complexity:
819
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
10
Defined Bond Stereocenter Count:
0
Exact Mass:
458.376g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
458.727g/mol
Monoisotopic Mass:
458.376g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
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