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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H30O5
Molecular Weight 374.4706
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6,7-DIDEHYDRO-20-HYDROXY-6-METHYLPREDNISOLONE, (20R)-

SMILES

[H][C@@]12CC[C@](O)([C@H](O)CO)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])C=C(C)C4=CC(=O)C=C[C@]34C

InChI

InChIKey=JMHKIYMJXBCHCJ-RRTLQOAHSA-N
InChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,8-9,14-15,17-19,23,25-27H,5,7,10-11H2,1-3H3/t14-,15-,17-,18+,19+,20-,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H30O5
Molecular Weight 374.4706
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:50:48 UTC 2023
Edited
by admin
on Sat Dec 16 10:50:48 UTC 2023
Record UNII
595B86Q648
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6,7-DIDEHYDRO-20-HYDROXY-6-METHYLPREDNISOLONE, (20R)-
Common Name English
PREGNA-1,4,6-TRIEN-3-ONE, 11,17,20,21-TETRAHYDROXY-6-METHYL-, (11.BETA.,20R)-
Systematic Name English
6,7-DIDEHYDRO-20-HYDROXY METHYLPREDNISOLONE, (20R)-
Common Name English
11.BETA.,17.ALPHA.,20.BETA.,21-TETRAHYDROXY-6-METHYLPREGNA-1,4,6-TRIENE-3-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
91667780
Created by admin on Sat Dec 16 10:50:48 UTC 2023 , Edited by admin on Sat Dec 16 10:50:48 UTC 2023
PRIMARY
FDA UNII
595B86Q648
Created by admin on Sat Dec 16 10:50:48 UTC 2023 , Edited by admin on Sat Dec 16 10:50:48 UTC 2023
PRIMARY
CAS
1361384-42-0
Created by admin on Sat Dec 16 10:50:48 UTC 2023 , Edited by admin on Sat Dec 16 10:50:48 UTC 2023
PRIMARY
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