Atom Biology General Molecule Reaction Tools Trial Virus

Bond Type Codes in Ketcher File

Q

What are bond type codes supported by Ketcher file?

✍: FYIcenter.com

A

Ketcher file supports the following bond type codes: 

Single bond -  
  "type": 1

Double bond -
  "type": 2

Triple Bond -
  "type": 3

Any bond -
  "type": 8

Aromatic bond -
  "type": 4

Single/double bond -
  "type": 5

Single/aromatic bond -
  "type": 6

Double/aromatic bond - 
  "type": 7,

Dative bond - 
  "type": 9

Hydrogen bond -
  "type": 10

Single up bond -
  "type": 1,
  "stereo": 1
  
Single down bond -
  "type": 1,
  "stereo": 6

Single up/down bond -
  "type": 1,
  "stereo": 4

Double cis/trans bond -
  "type": 2,
  "stereo": 3

You can see all bond types list on the Ketcher editor UI too:

List of Bond Types Supported by Ketcher
List of Bond Types Supported by Ketcher

 

⇒ Molecule with Substituted Functional Group

⇐ Molecule Structure with Directed Bonds

⇑ Ketcher File Format for Chemical Structures

⇑⇑ Ketcher - Chemical Structure Editor

2024-02-18, 1085🔥, 0💬

Atom Biology General Molecule Reaction Tools Trial Virus