2-(2'-HYDROXYTETRACOSANOYLAMINO)-OCTADECANE-1,3,4-TRIOL, (2S,3S,4R,2'R)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H85NO5
Molecular Weight	684.128
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(2'-HYDROXYTETRACOSANOYLAMINO)-OCTADECANE-1,3,4-TRIOL, (2S,3S,4R,2'R)-

Structure Search

SMILES

CCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCCCCC

InChI

InChIKey=ZFUXWVVVWGWGPQ-QLLOZFISSA-N

InChI=1S/C42H85NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(46)42(48)43-38(37-44)41(47)39(45)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h38-41,44-47H,3-37H2,1-2H3,(H,43,48)/t38-,39+,40+,41-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C42H85NO5
Molecular Weight	684.128
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:15:59 UTC 2023` Edited by `admin` on `Sat Dec 16 10:15:59 UTC 2023`
Record UNII	WCK3J2NNE4
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2-(2'-HYDROXYTETRACOSANOYLAMINO)-OCTADECANE-1,3,4-TRIOL, (2S,3S,4R,2'R)-

Common Name

English

ELASTICAMIDE

Common Name

English

(2S,3S,4R,2'R)-2-(2'-HYDROXYTETRACOSANOYLAMINO)-OCTADECANE-1,3,4-TRIOL

Systematic Name

English

N-(2R-HYDROXYTETRACOSANOYL)-PHYTOCERAMIDE

Common Name

English

TETRACOSANAMIDE, N-((1S,2S,3R)-2,3-DIHYDROXY-1-(HYDROXYMETHYL)HEPTADECYL)-2-HYDROXY-, (2R)-

Systematic Name

English

(2S,3S,4R)-2-((2'R)-2'-HYDROXYTETRACOSANOYLAMINO)-1,3,4-OCTADECANETRIOL

Systematic Name

English

(2S,3S,4R,2'R)-2-(2'-HYDROXYTETRACOSANOYLAMINO)-OCTADECANE-1,3,4-TRIOL, (+)-

Systematic Name

English

Code System Code Type Description

FDA UNII

WCK3J2NNE4

Created by admin on Sat Dec 16 10:16:00 UTC 2023 , Edited by admin on Sat Dec 16 10:16:00 UTC 2023

PRIMARY

EPA CompTox

DTXSID701152146

Created by admin on Sat Dec 16 10:16:00 UTC 2023 , Edited by admin on Sat Dec 16 10:16:00 UTC 2023

PRIMARY

PUBCHEM

10212035

Created by admin on Sat Dec 16 10:16:00 UTC 2023 , Edited by admin on Sat Dec 16 10:16:00 UTC 2023

PRIMARY

CAS

154801-30-6

Created by admin on Sat Dec 16 10:16:00 UTC 2023 , Edited by admin on Sat Dec 16 10:16:00 UTC 2023

PRIMARY

Related Record Type Details


					6L966A1IMR

WHEAT BRAN

PARENT -> CONSTITUENT ALWAYS PRESENT