TP-6208

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 Search

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

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 `Sat Dec 16 14:46:31 GMT 2023` Edited by `admin` on `Sat Dec 16 14:46:31 GMT 2023`
Record UNII	8CP1B1XJ46
Record Status	`Validated (UNII)`
Record Version

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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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