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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H40O7
Molecular Weight 488.613
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMEBUCORT

SMILES

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

InChI

InChIKey=QRRVOCXLQYLNEC-PPJDWOAVSA-N
InChI=1S/C28H40O7/c1-6-7-24(33)35-28(23(32)15-34-17(3)29)11-9-20-19-12-16(2)21-13-18(30)8-10-26(21,4)25(19)22(31)14-27(20,28)5/h13,16,19-20,22,25,31H,6-12,14-15H2,1-5H3/t16-,19-,20-,22-,25+,26-,27-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H40O7
Molecular Weight 488.613
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:20:57 UTC 2023
Edited
by admin
on Fri Dec 15 17:20:57 UTC 2023
Record UNII
7YRF8G0G0F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMEBUCORT
INN  
INN  
Official Name English
amebucort [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C521
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
Code System Code Type Description
CAS
83625-35-8
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
WIKIPEDIA
Amebucort
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
INN
5810
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
EPA CompTox
DTXSID60232466
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
EVMPD
SUB05405MIG
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
FDA UNII
7YRF8G0G0F
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
ChEMBL
CHEMBL2104661
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
SMS_ID
100000087172
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
NCI_THESAURUS
C74406
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
PUBCHEM
3086167
Created by admin on Fri Dec 15 17:20:57 UTC 2023 , Edited by admin on Fri Dec 15 17:20:57 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY