AG01EO3W

Name: 5α-Pregnane-3β,6α-diol-20-one
Brand: Angene Chemical
SKU: AG01EO3W

21853-11-2 | 5α-Pregnane-3β,6α-diol-20-one

AG01EO3W

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CAS Number	21853-11-2
Catalog Number	AG01EO3W(AGN-PC-0O7WRJ)
Chemical Name	5α-Pregnane-3β,6α-diol-20-one
IUPAC Name	1-[(3S,5S,6S,8R,9S,10R,13S,14S,17S)-3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
InChI	InChI=1S/C21H34O3/c1-12(22)15-4-5-16-14-11-19(24)18-10-13(23)6-8-21(18,3)17(14)7-9-20(15,16)2/h13-19,23-24H,4-11H2,1-3H3/t13-,14-,15+,16-,17-,18+,19-,20+,21+/m0/s1
InChI Key	HHUZGDMRRLQZIQ-WAXVQEINSA-N
MDL Number	MFCD00200026
Molecular Formula	C21H34O3
Molecular Weight	334.4929
SMILES	C[C@]12CC[C@H](O)C[C@]1([H])[C@@H](O)C[C@@]1([H])[C@]3([H])CC[C@H](C(=O)C)[C@@]3(C)CC[C@]21[H]
Synonyms	5\|A-Pregnane-3\|A,6\|A-diol-20-one, 5alpha-Pregnane-3beta,6alpha-diol-20-one, ZINC83261528, 21853-11-2, HY-109564, CS-0031562, 6-alpha-Hydroxypregnanolone, CID11035016, 5(alpha)-Pregnane-3(beta),6(alpha)-diol-20-one,

Complexity	531
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	9
Defined Bond Stereocenter Count	0
Exact Mass	334.251g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	334.5g/mol
Monoisotopic Mass	334.251g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited