CAS 72809-08-6 | 9-Octadecenamide, N-[2-hydroxy-1-(hydroxymethyl)ethyl]-, (9Z)- | CAS Number 72809-08-6

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72809-08-6 | 9-Octadecenamide, N-[2-hydroxy-1-(hydroxymethyl)ethyl]-, (9Z)-

CAS No: 72809-08-6 Catalog No: AG005EM0 MDL No:

Product Description

Catalog Number:

AG005EM0

Chemical Name:

9-Octadecenamide, N-[2-hydroxy-1-(hydroxymethyl)ethyl]-, (9Z)-

CAS Number:

72809-08-6

Molecular Formula:

C21H41NO3

Molecular Weight:

355.5551

IUPAC Name:

N-(1,3-dihydroxypropan-2-yl)octadec-9-enamide

InChI:

InChI=1S/C21H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(25)22-20(18-23)19-24/h9-10,20,23-24H,2-8,11-19H2,1H3,(H,22,25)

InChI Key:

LGDVTFHRZXBSJM-UHFFFAOYSA-N

SMILES:

CCCCCCCC/C=C\CCCCCCCC(=O)NC(CO)CO

Properties

Complexity:

314

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

355.309g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

355.563g/mol

Monoisotopic Mass:

355.309g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.7

Literature

Title	Journal
Regulation of neural progenitor cell motility by ceramide and potential implications for mouse brain development.	Journal of neurochemistry 20080701
Synthesis and characterization of novel ceramide analogs for induction of apoptosis in human cancer cells.	Cancer letters 20020708