HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-(Icosa-5,8,11,14,17-pentaenoylamino)ethoxy-oxido-oxophosphanium

HCID 178442882
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCC=CCC=CCC=CCC=CCC=CCCCC(=O)NCCOP(=O)=O
InChIKey
CBTGAHLXCYTDRE-UHFFFAOYSA-N
Molecular formula
C22H34NO4P
Average molar mass
407.5 g/mol
Monoisotopic mass
407.22254556

Names & identifiers

Preferred name
2-(Icosa-5,8,11,14,17-pentaenoylamino)ethoxy-oxido-oxophosphanium
IUPAC
2-(icosa-5,8,11,14,17-pentaenoylamino)ethoxy-oxido-oxophosphanium

Names & synonyms

SCHEMBL7217574

Database identifiers

PubChem CID
173248034

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
78.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
16
Heavy atoms
28
Formal charge
0
Complexity
545

Related reactions

1 records
New reaction record
HRID 213050 reaction equation
HRID 213050As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes