Pregnane-3,20-Dione, (5.Beta.)-
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Product Description
Product
Pregnane-3,20-Dione, (5.Beta.)-
CAS
128-23-4
Formula
C21H32O2
Synonym
Pregnane-3,20-dione, (5ß)-; PREGNANEDIONE; UNII-105J2Q45A0; 5-BETA-DIHYDROPROGESTERONE; 5beta-Dihydroprogesterone; 5-BETA-PREGNAN-3,20-DIONE; 5beta-Pregnan-3,20-dione; 5beta-Pregnane-3,20-dione (8CI); 5B-Pregnan-3,20-dione; 5B-pregnane-3,20-dione; 5ß-Dihydroprogesterone; 5ß-Pregnan-3,20-dione; 5ß-Pregnane-3,20-dione; 5ß-Pregnanedione; NSC 82868; Pregnane-3,20-dione, (5beta)- (9CI)
Typical Product Specifications
Molecular weight
316.48
SMILES
O=C1C[C@H]2CC[C@H]3[C@@H]4CC[C@@H]([C@@]4(CC[C@H]3[C@@]2(CC1)C)C)C(=O)C
InChI
1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14,16-19H,4-12H2,1-3H3/t14-,16+,17-,18+,19+,20+,21-/m0/s1
InChIKey
XMRPGKVKISIQBV-IWQCLKLKSA-N
log P (octanol-water)
3.460
Melting Point
123 ° C
Atmospheric OH Rate Constant
3.85E-11 cm3/molecule-sec
Chemical Structure
Class
Pregnane-3,20-Dione, (5.Beta.)-
Product Description
Product
Pregnane-3,20-Dione, (5.Beta.)-
CAS
128-23-4
Formula
C21H32O2
Synonym
Pregnane-3,20-dione, (5ß)-; PREGNANEDIONE; UNII-105J2Q45A0; 5-BETA-DIHYDROPROGESTERONE; 5beta-Dihydroprogesterone; 5-BETA-PREGNAN-3,20-DIONE; 5beta-Pregnan-3,20-dione; 5beta-Pregnane-3,20-dione (8CI); 5B-Pregnan-3,20-dione; 5B-pregnane-3,20-dione; 5ß-Dihydroprogesterone; 5ß-Pregnan-3,20-dione; 5ß-Pregnane-3,20-dione; 5ß-Pregnanedione; NSC 82868; Pregnane-3,20-dione, (5beta)- (9CI)
Typical Product Specifications
Molecular weight
316.48
SMILES
O=C1C[C@H]2CC[C@H]3[C@@H]4CC[C@@H]([C@@]4(CC[C@H]3[C@@]2(CC1)C)C)C(=O)C
InChI
1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14,16-19H,4-12H2,1-3H3/t14-,16+,17-,18+,19+,20+,21-/m0/s1
InChIKey
XMRPGKVKISIQBV-IWQCLKLKSA-N
log P (octanol-water)
3.460
Melting Point
123 ° C
Atmospheric OH Rate Constant
3.85E-11 cm3/molecule-sec
Chemical Structure
Class
