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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H24FN3O6
Molecular Weight 493.4837
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETAMIDE, N-((1S,9S)-9-ETHYL-5-FLUORO-2,3,9,10,13,15-HEXAHYDRO-9-HYDROXY-4-METHYL-10,13-DIOXO-1H,12H-BENZO(DE)PYRANO(3',4':6,7)INDOLIZINO(1,2-B)QUINOLIN-1-YL)-2-HYDROXY-

SMILES

CC[C@@]1(O)C(=O)OCC2=C1C=C3N(CC4=C5[C@H](CCC6=C5C(=CC(F)=C6C)N=C34)NC(=O)CO)C2=O

InChI

InChIKey=PLXLYXLUCNZSAA-QLXKLKPCSA-N
InChI=1S/C26H24FN3O6/c1-3-26(35)15-6-19-23-13(8-30(19)24(33)14(15)10-36-25(26)34)22-17(28-20(32)9-31)5-4-12-11(2)16(27)7-18(29-23)21(12)22/h6-7,17,31,35H,3-5,8-10H2,1-2H3,(H,28,32)/t17-,26-/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H24FN3O6
Molecular Weight 493.4837
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:24:19 GMT 2023
Edited
by admin
on Sat Dec 16 14:24:19 GMT 2023
Record UNII
OQM5SD32BQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACETAMIDE, N-((1S,9S)-9-ETHYL-5-FLUORO-2,3,9,10,13,15-HEXAHYDRO-9-HYDROXY-4-METHYL-10,13-DIOXO-1H,12H-BENZO(DE)PYRANO(3',4':6,7)INDOLIZINO(1,2-B)QUINOLIN-1-YL)-2-HYDROXY-
Systematic Name English
N-((1S,9S)-9-ETHYL-5-FLUORO-2,3,9,10,13,15-HEXAHYDRO-9-HYDROXY-4-METHYL-10,13-DIOXO-1H,12H-BENZO(DE)PYRANO(3',4':6,7)INDOLIZINO(1,2-B)QUINOLIN-1-YL)-2-HYDROXYACETAMIDE
Systematic Name English
DXD
Common Name English
Code System Code Type Description
PUBCHEM
117888634
Created by admin on Sat Dec 16 14:24:19 GMT 2023 , Edited by admin on Sat Dec 16 14:24:19 GMT 2023
PRIMARY
CAS
1599440-33-1
Created by admin on Sat Dec 16 14:24:19 GMT 2023 , Edited by admin on Sat Dec 16 14:24:19 GMT 2023
PRIMARY
FDA UNII
OQM5SD32BQ
Created by admin on Sat Dec 16 14:24:19 GMT 2023 , Edited by admin on Sat Dec 16 14:24:19 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
PARENT -> METABOLITE ACTIVE
METABOLITE ACTIVE -> PARENT