SULTRIECIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H33O8S.Na
Molecular Weight	492.558
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	4
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].CCCCC\C=C\C=C/C=C\[C@H](O)[C@H](C)[C@H](C\C=C\[C@@H]1OC(=O)C=C[C@@H]1O)OS([O-])(=O)=O

InChI

InChIKey=GAYWDMXGCWYFCK-CRKRICINSA-M

InChI=1S/C23H34O8S.Na/c1-3-4-5-6-7-8-9-10-11-13-19(24)18(2)21(31-32(27,28)29)14-12-15-22-20(25)16-17-23(26)30-22;/h7-13,15-22,24-25H,3-6,14H2,1-2H3,(H,27,28,29);/q;+1/p-1/b8-7+,10-9-,13-11-,15-12+;/t18-,19-,20-,21-,22-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C23H33O8S
Molecular Weight	469.568
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	4
Optical Activity	UNSPECIFIED

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:42:53 GMT 2023` Edited by `admin` on `Sat Dec 16 08:42:53 GMT 2023`
Record UNII	LJ917WL9P0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SULTRIECIN

Common Name

English

(+)-SULTRIECIN

Common Name

English

2H-PYRAN-2-ONE, 5,6-DIHYDRO-5-HYDROXY-6-((1E,4S,5S,6S,7Z,9Z,11E)-6-HYDROXY-5-METHYL-4-(SULFOOXY)-1,7,9,11-HEPTADECATETRAEN-1-YL)-, SODIUM SALT (1:1), (5S,6S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

LJ917WL9P0

Created by admin on Sat Dec 16 08:42:53 GMT 2023 , Edited by admin on Sat Dec 16 08:42:53 GMT 2023

PRIMARY

PUBCHEM

45379048

Created by admin on Sat Dec 16 08:42:53 GMT 2023 , Edited by admin on Sat Dec 16 08:42:53 GMT 2023

PRIMARY

CAS

1228462-25-6

Created by admin on Sat Dec 16 08:42:53 GMT 2023 , Edited by admin on Sat Dec 16 08:42:53 GMT 2023

PRIMARY

Related Record Type Details


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SULTRIECIN FREE ACID

PARENT -> SALT/SOLVATE