Pregnenolone sulfate
-
Pregnenolone sulfate
structure -
-
CAS No:
1247-64-9
-
Formula:
C21H32O5S
-
Chemical Name:
Pregnenolone sulfate
-
Synonyms:
Pregn-5-en-20-one,3-(sulfooxy)-,(3β)-;Pregn-5-en-20-one,3β-hydroxy-,hydrogen sulfate;(3β)-3-(Sulfooxy)pregn-5-en-20-one;Pregnenolone hydrogen sulfate;3β-Hydroxypregn-5-en-20-one sulfate;Pregnenolone sulfate;Pregnenolone 3β-sulfate;Pregnenolone monosulfate;Pregn-5-en-20-one-3β-yl sulfate;Pregn-5-en-20-on-3β-yl sulfuric acid;20-Oxo-5-pregnen-3β-yl sulfate;Pregnenolone 3-sulfate;3β-Hydroxy-5-pregnen-20-one monosulfate;5-Pregnen-3β-sulfate-20-one;Pregnenolone sulfate conjugate;885262-32-8
-
CAS No:
Description
Solid
Solid
Pregnenolone sulfate is a steroid sulfate. It has a role as an EC 2.7.1.33 (pantothenate kinase) inhibitor and a human metabolite. It derives from a pregnenolone. It is a conjugate acid of a pregnenolone sulfate(1-).
Characteristics
89
3.8
Solid
203.91 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|206.2 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|206.2 Ų [M-H]-
Pregnenolone sulfate Use and Manufacturing
Lipids -> Sterol Lipids [ST] -> Steroid conjugates [ST05] -> Sulfates [ST0502]
Computed Properties
Molecular Weight:396.5
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:396.19704529
Monoisotopic Mass:396.19704529
Topological Polar Surface Area:89
Heavy Atom Count:27
Complexity:766
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Learn More Other Chemicals
-
3H-Pyrazol-3-one, 4,5-diamino-1,2-dihydro-, sulfate (1:1)
97358-51-5
-
Pyridine, 2,5-dibromo-, sulfate (1:1)
84473-61-0
-
Benzenemethanaminium, N,N-dimethyl-N-(phenylmethyl)-, methyl sulfate (1:1)
74070-70-5
-
4H-1,2,4-Triazolium, 5-[2-[4-[bis(phenylmethyl)amino]phenyl]diazenyl]-1,4-dimethyl-, methyl sulfate (1:1) Formula
72919-81-4
-
Benzenediazonium, 2-methoxy-4-(phenylamino)-, sulfate (1:1) Formula
36305-05-2
-
Pyridinium, 1-[2-[[4-[2-(2,6-dichloro-4-nitrophenyl)diazenyl]phenyl]ethylamino]ethyl]-, sulfate (1:1) Formula
64086-81-3
-
Benzenaminium, 4-[2-[[4-[2-[2,5-dichloro-4-[(dimethylamino)sulfonyl]phenyl]diazenyl]phenyl]ethylamino]ethoxy]-N,N,N-trimethyl-, methyl sulfate (1:1) Structure
84041-75-8
-
Benzenaminium, 4-[[[(3,4-dichlorophenyl)amino]carbonyl]amino]-N,N,N-trimethyl-, methyl sulfate (1:1) Structure
93777-84-5
-
What is Benzoic acid, 3-hydroxy-4,5-dimethoxy-, 2-(aminoiminomethyl)hydrazide, sulfate (2:1) (salt)
35607-24-0
-
What is Acridinium, 3,6-diamino-10-methyl-, sulfate (1:1)
101952-51-6