OXYTETRACYCLINE MONOSTEARYL FUMARATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H40O4.C22H24N2O9
Molecular Weight	828.9846
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of OXYTETRACYCLINE MONOSTEARYL FUMARATE

Structure Search

SMILES

CCCCCCCCCCCCCCCCCCOC(=O)\C=C\C(O)=O.[H][C@@]12[C@@H](O)[C@@]3([H])C(C(=O)C4=C(O)C=CC=C4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@H]2N(C)C

InChI

InChIKey=XFIDSFXJKCMVSU-UHNDIHAISA-N

InChI=1S/C22H24N2O9.C22H40O4/c1-21(32)7-5-4-6-8(25)9(7)15(26)10-12(21)17(28)13-14(24(2)3)16(27)11(20(23)31)19(30)22(13,33)18(10)29;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-26-22(25)19-18-21(23)24/h4-6,12-14,17,25,27-29,32-33H,1-3H3,(H2,23,31);18-19H,2-17,20H2,1H3,(H,23,24)/b;19-18+/t12-,13-,14+,17+,21-,22+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C22H40O4
Molecular Weight	368.5506
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C22H24N2O9
Molecular Weight	460.434
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:23:11 UTC 2023` Edited by `admin` on `Fri Dec 15 15:23:11 UTC 2023`
Record UNII	9AK279IUC9
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

OXYTETRACYCLINE MONOSTEARYL FUMARATE

Common Name

English

FUMARIC ACID, MONOOCTADECYL ESTER, COMPD. WITH 4-(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,5,6,10,12,12A-HEXAHYDROXY-6-METHYL-1,11-DIOXO-2-NAPHTHACENECARBOXAMIDE

Systematic Name

English

2-NAPHTHACENECARBOXAMIDE, 4-(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,5,6,10,12,12A-HEXAHYDROXY-6-METHYL-1,11-DIOXO-, COMPD. WITH MONOOCTADECYL FUMARATE

Systematic Name

English

Code System Code Type Description

CAS

28083-24-1

Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023

PRIMARY

FDA UNII

9AK279IUC9

Created by admin on Fri Dec 15 15:23:11 UTC 2023 , Edited by admin on Fri Dec 15 15:23:11 UTC 2023

PRIMARY

Related Record Type Details