FAUC-50

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H33N3O5S2
Molecular Weight	519.677
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(OCCCSSCCN)C=CC(CCNC[C@H](O)C2=C3C=CC(=O)NC3=C(O)C=C2)=C1

InChI

InChIKey=MQROXSOVKCABJV-NRFANRHFSA-N

InChI=1S/C25H33N3O5S2/c1-32-23-15-17(3-7-22(23)33-12-2-13-34-35-14-10-26)9-11-27-16-21(30)18-4-6-20(29)25-19(18)5-8-24(31)28-25/h3-8,15,21,27,29-30H,2,9-14,16,26H2,1H3,(H,28,31)/t21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H33N3O5S2
Molecular Weight	519.677
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 17:29:15 UTC 2023` Edited by `admin` on `Sat Dec 16 17:29:15 UTC 2023`
Record UNII	CE67FN5E7V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FAUC-50

Code

English

5-[(1R)-2-[[2-[4-[3-[(2-Aminoethyl)dithio]propoxy]-3-methoxyphenyl]ethyl]amino]-1-hydroxyethyl]-8-hydroxy-2(1H)-quinolinone

Systematic Name

English

2(1H)-Quinolinone, 5-[(1R)-2-[[2-[4-[3-[(2-aminoethyl)dithio]propoxy]-3-methoxyphenyl]ethyl]amino]-1-hydroxyethyl]-8-hydroxy-

Systematic Name

English

FAUC50

Code

English

Code System Code Type Description

EPA CompTox

DTXSID101104232