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Home > Aldehydes > 906337-64-2
906337-64-2 | Hydrocortisone21-AldehydeHydrate
CAS No: 906337-64-2 Catalog No: AG01E27N MDL No:
Product Description
Catalog Number:
AG01E27N
Chemical Name:
Hydrocortisone21-AldehydeHydrate
CAS Number:
906337-64-2
IUPAC Name:
2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoacetaldehyde;hydrate
InChI:
InChI=1S/C21H28O5.H2O/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19;/h9,11,14-16,18,24,26H,3-8,10H2,1-2H3;1H2/t14-,15-,16-,18+,19-,20-,21-;/m0./s1
InChI Key:
RHUDCNJUXZQHJL-WDCKKOMHSA-N
UNII:
FOL1F81T4A
Properties
Complexity:
711
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
7
Defined Bond Stereocenter Count:
0
Exact Mass:
378.204g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
378.465g/mol
Monoisotopic Mass:
378.204g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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