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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H32O2
Molecular Weight 340.4998
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BAY-1007626

SMILES

CC[C@@]12CC[C@]3([H])[C@@]4([H])CCC(=O)C=C4CC[C@@]3([H])[C@]2([H])[C@]5([H])C[C@]5([H])[C@]61CCCO6

InChI

InChIKey=CKSCPQVTRJRMNK-ZBAXIGARSA-N
InChI=1S/C23H32O2/c1-2-22-10-8-17-16-7-5-15(24)12-14(16)4-6-18(17)21(22)19-13-20(19)23(22)9-3-11-25-23/h12,16-21H,2-11,13H2,1H3/t16-,17+,18+,19+,20-,21+,22-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H32O2
Molecular Weight 340.4998
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 Jun 26 14:58:05 UTC 2021
Edited
by admin
on Sat Jun 26 14:58:05 UTC 2021
Record UNII
53JZL363WJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BAY-1007626
Code English
18-METHYL-15.BETA.,16.BETA.-METHYLENE-19-NOR-20-SPIROX-4-EN-3-ONE
Systematic Name English
SPIRO(3'H-CYCLOPROPA(15,16)GONA-4,15-DIENE-17,2'(3'H)-FURAN)-3-ONE, 13-ETHYL-4',5',15,16-TETRAHYDRO-, (15.ALPHA.,16.ALPHA.,17.BETA.)-
Common Name English
Code System Code Type Description
CAS
1000371-89-0
Created by admin on Sat Jun 26 14:58:05 UTC 2021 , Edited by admin on Sat Jun 26 14:58:05 UTC 2021
PRIMARY
PUBCHEM
71812154
Created by admin on Sat Jun 26 14:58:05 UTC 2021 , Edited by admin on Sat Jun 26 14:58:05 UTC 2021
PRIMARY
FDA UNII
53JZL363WJ
Created by admin on Sat Jun 26 14:58:05 UTC 2021 , Edited by admin on Sat Jun 26 14:58:05 UTC 2021
PRIMARY
Related Record Type Details
TARGET -> AGONIST