(2S,4R)-hypoglycin B

AlkaPlorer ID: AK013069

Synonym: 'L-gamma-glutamyl-(2S,4S)-hypoglycin A', '', 'L-gamma-glutamyl-L-hypoglycin', 'L-gamma-Glutamyl-L-hypoglycin', '(2S,4S)-hypoglycin B', 'hypoglycin B'

IUPAC Name: (2S)-2-amino-5-[[(1S)-1-carboxy-2-[(1S)-2-methylidenecyclopropyl]ethyl]amino]-5-oxopentanoic acid

Structure

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

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InChI: InChI=1S/C12H18N2O5/c1-6-4-7(6)5-9(12(18)19)14-10(15)3-2-8(13)11(16)17/h7-9H,1-5,13H2,(H,14,15)(H,16,17)(H,18,19)/t7-,8-,9-/m0/s1

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InChIKey: UYDZYCPIQSRXKU-CIUDSAMLSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Blighia sapida Blighia Sapindaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 270.285

TPSA: 133.21

MolLogP: 0.5544000000000004

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

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