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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 of FAUC-50

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
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
CE67FN5E7V
Record Status Validated (UNII)
Record Version