9-(((2E)-4-((2S,3R,4R,5S)-3,4-DIHYDROXY-5-((3-HYDROXY-4,5-DIMETHYLTETRAHYDROFURAN-2-YL)METHYL)TETRAHYDRO-2H-PYRAN-2-YL)-3-METHYLBUT-2-ENOYL)OXY)NONANOIC ACID

Details

Stereochemistry	MIXED
Molecular Formula	C26H44O9
Molecular Weight	500.6222
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 8
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 9-(((2E)-4-((2S,3R,4R,5S)-3,4-DIHYDROXY-5-((3-HYDROXY-4,5-DIMETHYLTETRAHYDROFURAN-2-YL)METHYL)TETRAHYDRO-2H-PYRAN-2-YL)-3-METHYLBUT-2-ENOYL)OXY)NONANOIC ACID

Structure Search

SMILES

CC1OC(C[C@H]2CO[C@@H](C\C(C)=C\C(=O)OCCCCCCCCC(O)=O)[C@H](O)[C@@H]2O)C(O)C1C

InChI

InChIKey=HYAMBVYSAPUNQS-LFKUFGPNSA-N

InChI=1S/C26H44O9/c1-16(13-23(29)33-11-9-7-5-4-6-8-10-22(27)28)12-20-26(32)25(31)19(15-34-20)14-21-24(30)17(2)18(3)35-21/h13,17-21,24-26,30-32H,4-12,14-15H2,1-3H3,(H,27,28)/b16-13+/t17?,18?,19-,20-,21?,24?,25+,26-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H44O9
Molecular Weight	500.6222
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	4 / 8
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:26:31 UTC 2023` Edited by `admin` on `Sat Dec 16 08:26:31 UTC 2023`
Record UNII	3U19O68RXX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

9-(((2E)-4-((2S,3R,4R,5S)-3,4-DIHYDROXY-5-((3-HYDROXY-4,5-DIMETHYLTETRAHYDROFURAN-2-YL)METHYL)TETRAHYDRO-2H-PYRAN-2-YL)-3-METHYLBUT-2-ENOYL)OXY)NONANOIC ACID

Systematic Name

English

MUPIROCIN CALCIUM IMPURITY I [EP IMPURITY]

Common Name

English

Code System Code Type Description

FDA UNII

3U19O68RXX

Created by admin on Sat Dec 16 08:26:31 UTC 2023 , Edited by admin on Sat Dec 16 08:26:31 UTC 2023

PRIMARY

PUBCHEM

135390779

Created by admin on Sat Dec 16 08:26:31 UTC 2023 , Edited by admin on Sat Dec 16 08:26:31 UTC 2023

PRIMARY

Related Record Type Details


					RG38I2P540

MUPIROCIN CALCIUM

PARENT -> IMPURITY

Comments:

UNSPECIFIED

Qualification:

EP