Registration Dossier

General information

Inventory

No inventory information available

Reference substance information

Synonyms
Names:
Identifier:
IUPAC name
Pregna-1,4-diene-3,20-dione, 11,17-dihydroxy-6-methyl-, (6α,11β)-
Identifier:
common name
Deltamedrane
Identifier:
other: InChl
1S/C22H30O4/c1-12-9-15-16-6-8-22(26,13(2)23)21(16,4)11-18(25)19(15)20(3)7-5-14(24)10-17(12)20/h5,7,10,12,15-16,18-19,25-26H,6,8-9,11H2,1-4H3/t12?,15-,16-,18?,19+,20-,21-,22-/m0/s1
Identifier:
other: Molecular formula
C22H30O4
Identifier:
other: SMILES notation
CC1CC2C3CCC(C3(CC(C2C4(C1=CC(=O)C=C4)C)O)C)(C(=O)C)O
11.beta.,17.alpha.-Dihydroxy-6.alpha.-methylpregna-1,4-diene-3,20-dione

CAS information

CAS number:
6870-94-6

Molecular and structural information

Molecular formula:
C22H30O4
Molecular weight:
358.477
SMILES notation:
[C@@]12(C(CC[C@]1(O)C(=O)C)C4C([C@H](C2)O)[C@@]3(C(=CC(C=C3)=O)[C@H](C4)C)C)C
InChl:
InChI=1/C22H30O4/c1-12-9-15-16-6-8-22(26,13(2)23)21(16,4)11-18(25)19(15)20(3)7-5-14(24)10-17(12)20/h5,7,10,12,15-16,18-19,25-26H,6,8-9,11H2,1-4H3/t12-,15?,16?,18-,19?,20-,21-,22-/m0/s1
Structural formula:
Chemical structure