Molecule

hypoglycin A

AlkaPlorer ID: AK001966

Synonym: 'L-Hypoglycin', '(2S,4S)-hypoglycin A', '', '(+)-hypoglycin A'

IUPAC Name: (2S)-2-amino-3-[(1S)-2-methylidenecyclopropyl]propanoic acid

SMILES: C=C1C[C@H]1C[C@H](N)C(=O)O

InChI: InChI=1S/C7H11NO2/c1-4-2-5(4)3-6(8)7(9)10/h5-6H,1-3,8H2,(H,9,10)/t5-,6-/m0/s1

InChIKey: OOJZCXFXPZGUBJ-WDSKDSINSA-N

PubChem CID: 441451

CAS: 156-56-9

SuperNatural Ⅲ: SN0270965-03

NPASS: NPC312018

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Blighia sapida	Blighia	Sapindaceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Arachis hypogaea	Arachis	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Apis cerana	Apis	Apidae	Hymenoptera	Insecta	Arthropoda	Metazoa	Eukaryota

Molecule Weight: 141.17000000000002

TPSA？: 63.32000000000001

MolLogP？: 0.3645000000000001

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 1

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi

AKRT ID	Reaction	Reaction Link ID
AKRT001717	C=C1C[C@H]1C[C@H](N)C(=O)O.N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O>>C=C1C[C@H]1C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O	enzymemap_32878