U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C28H22NO6P
Molecular Weight 499.4511
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FOSQUIDONE, (S)-

SMILES

C[C@@H]1C2=C3C(=CN2CC4=CC=CC=C14)C(=O)C5=C(OP(O)(=O)OCC6=CC=CC=C6)C=CC=C5C3=O

InChI

InChIKey=UXTSQCOOUJTIAC-KRWDZBQOSA-N
InChI=1S/C28H22NO6P/c1-17-20-11-6-5-10-19(20)14-29-15-22-25(26(17)29)27(30)21-12-7-13-23(24(21)28(22)31)35-36(32,33)34-16-18-8-3-2-4-9-18/h2-13,15,17H,14,16H2,1H3,(H,32,33)/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H22NO6P
Molecular Weight 499.4511
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:13:37 UTC 2023
Edited
by admin
on Sat Dec 16 10:13:37 UTC 2023
Record UNII
ICU86V9W24
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FOSQUIDONE, (S)-
Common Name English
PHOSPHORIC ACID, MONO(PHENYLMETHYL) MONO(5,8,13,14-TETRAHYDRO-14-METHYL-8,13-DIOXOBENZ(5,6)ISOINDOLO(2,1-B)ISOQUINOLIN-9-YL) ESTER, (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76969170
Created by admin on Sat Dec 16 10:13:37 UTC 2023 , Edited by admin on Sat Dec 16 10:13:37 UTC 2023
PRIMARY
FDA UNII
ICU86V9W24
Created by admin on Sat Dec 16 10:13:37 UTC 2023 , Edited by admin on Sat Dec 16 10:13:37 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER