Class: reaction
reaction
URI: chemrof:Reaction
Identifier prefixes
- RHEA
- KEGG.REACTION
- GO
- MetaCyc
- REACT
- EC
- MetaNetX
- SEED
- RetroRules
Children
- IsomeraseReaction - A reaction that converts a molecule from one isomer to another.
Referenced by Class
Attributes
Own
- has rinchi representation 1..1
- Description: Proposed Reactions InChI
- Range: ChemicalEncoding
- Example: RInChI=1.00.1S /layer2<>layer3<>layer4/d+/u2-0-1 None
- Example: C2H4O2/c1-2(3)4/h1H3,(H,3,4)!C2H6O/c1-2-3/h3H,2H2,1H3<>C4H8O2/c1-3-6-4(2)5/h3H2,1- 2H3!H2O/h1H2<>H2O4S/c1-5(2,3)4/h(H2,1,2,3,4): hydrolysis of ethyl acetate
- reaction➞left participants 0..*
- Range: ReactionParticipant
- reaction➞right participants 0..*
- Range: ReactionParticipant
- reaction➞direction 0..1
- Description: One of l->r, r->l, bidirectional, neutral
- Range: String
- reaction➞smarts string 0..1
- reaction➞is diastereoselective 0..1
- Range: Boolean
- reaction➞is stereo 0..1
- Range: Boolean
- reaction➞is balanced 0..1
- Range: Boolean
- reaction➞is transport 0..1
- Range: Boolean
- reaction➞is fully characterized 0..1
- Description: False if includes R-groups
- Range: Boolean
- reaction➞reaction center 0..1
- Range: String
- reaction➞description 0..1
- Range: String