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Details

Stereochemistry EPIMERIC
Molecular Formula C27H29FN4O8
Molecular Weight 556.5396
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TP-6208

SMILES

CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(F)C=C(N5C6CCCN6CC5=O)C(O)=C4C(=O)C3=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O

InChI

InChIKey=KDUNVUXNBLIXLC-UEFCNIQWSA-N
InChI=1S/C27H29FN4O8/c1-30(2)20-12-7-10-6-11-13(28)8-14(32-15-4-3-5-31(15)9-16(32)33)21(34)18(11)22(35)17(10)24(37)27(12,40)25(38)19(23(20)36)26(29)39/h8,10,12,15,20,34,36-37,40H,3-7,9H2,1-2H3,(H2,29,39)/t10-,12-,15?,20-,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H29FN4O8
Molecular Weight 556.5396
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 4 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 01:08:39 GMT 2025
Edited
by admin
on Wed Apr 02 01:08:39 GMT 2025
Record UNII
8CP1B1XJ46
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TP-6208
Code English
ERAVACYCLINE METABOLITE (TP-6208)
Preferred Name English
(4S,4AS,5AR,12AS)-4-(DIMETHYLAMINO)-7-FLUORO-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-9-(2-OXO-5,6,7,7A-TETRAHYDRO-3H-PYRROLO(1,2-A)IMIDAZOL-1-YL)-4A,5,5A,6-TETRAHYDRO-4H-TETRACENE-2-CARBOXAMIDE
Systematic Name English
Code System Code Type Description
FDA UNII
8CP1B1XJ46
Created by admin on Wed Apr 02 01:08:39 GMT 2025 , Edited by admin on Wed Apr 02 01:08:39 GMT 2025
PRIMARY
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