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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

[H][C@@]12CC3=C(C(=O)C1=C(O)[C@]4(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]4([H])C2)C(O)=C(C=C3F)N5C6CCCN6CC5=O

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

Approval Year

Name Type Language
TP-6208
Code English
ERAVACYCLINE METABOLITE (TP-6208)
Common 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 Sat Dec 16 14:46:32 GMT 2023 , Edited by admin on Sat Dec 16 14:46:32 GMT 2023
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