9,10-Secocholesta-5,7,10(19)-triene-3,25-diol, monohydrate,(3b,5Z,7E)-


Chemical Name: 9,10-Secocholesta-5,7,10(19)-triene-3,25-diol, monohydrate,(3b,5Z,7E)-
CAS Number: 63283-36-3
Product Number: AG01CPBA(AGN-PC-0T7RYN)
Synonyms:
MDL No:
Molecular Formula: C27H46O3
Molecular Weight: 418.6523

Identification/Properties


Properties
Storage:
-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
418.662g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
418.345g/mol
Monoisotopic Mass:
418.345g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
655
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
5
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H300+H310+H330-H372
Precautionary Statements:
P260-P262-P280-P302+P352+P310-P304+P340+P310
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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