PECOCYCLINE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C29H35N3O10
Molecular Weight	585.6023
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@]3([H])[C@]([H])(N(C)C)C(O)=C(C(=O)NCN4CCCC(C4)C(O)=O)C(=O)[C@@]3(O)C(O)=C1C(=O)C5=C(O)C=CC=C5[C@@]2(C)O

InChI

InChIKey=LYOHRYSQMOWAQT-OSCKIKFWSA-N

InChI=1S/C29H35N3O10/c1-28(41)14-7-4-8-17(33)18(14)22(34)19-15(28)10-16-21(31(2)3)23(35)20(25(37)29(16,42)24(19)36)26(38)30-12-32-9-5-6-13(11-32)27(39)40/h4,7-8,13,15-16,21,33,35-36,41-42H,5-6,9-12H2,1-3H3,(H,30,38)(H,39,40)/t13?,15-,16-,21-,28+,29-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H35N3O10
Molecular Weight	585.6023
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: Elks J., The Dictionary of Drugs: Chemical Data: Chemical Data, Structures, retrieved from: https://books.google.ru/books?id=0vXTBwAAQBAJ&pg=PA937&lpg=PA937&dq=PECOCYCLINE&source=bl&ots=6JUfq8Vwvx&sig=ACfU3U0Px2jKfhrEqFa9tXmdlvyCPE_g-A&hl=ru&sa=X&ved=2ahUKEwidwejWpILjAhVvl4sKHY3DAkM4ChDoATAIegQIBxAB#v=onepage&q=PECOCYCLINE&f=false

Pecocycline, a synthetic tetracycline that was developed as an antibiotic. Information about the current use of this drug is not available.

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:29:21 GMT 2023` Edited by `admin` on `Fri Dec 15 15:29:21 GMT 2023`
Record UNII	0CG6O25ZC4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PECOCYCLINE

Official Name

English

N-((4-(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,6,10,12,12A-PENTAHYDROXY-6-METHYL-1,11-DIOXO-2-NAPHTHACENE CARBOXAMIDO)METHYL)NIPECOTIC ACID

Common Name

English

pecocycline [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C258