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InChIKey | IMXSCCDUAFEIOE-RITPCOANSA-N |
InChI | InChI=1S/C9H18N4O4/c1-5(7(14)15)13-6(8(16)17)3-2-4-12-9(10)11/h5-6,13H,2-4H2,1H3,(H,14,15)(H,16,17)(H4,10,11,12)/t5-,6+/m1/s1 |
SMILES | C[C@@H]([NH2+][C@@H](CCCNC(N)=[NH2+])C([O-])=O)C([O-])=O |
#reac | |
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Distinct reactions in my sandbox | 0 |
Distinct generic reactions in MNXref | 3 |
Distinct compatimentalized reactions in models | 1 |
Identifier | Description |
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metacycM:CPD-309 | D-octopine D-(+)-octopine L-arginine, N2-(1-carboxyethyl)-, (R)- L-arginine, N2-[(1R)-1-carboxyethyl]- N2-(1-carboxyethyl)-, (R)-L-arginine N2-(1-carboxyethyl)-L-arginine N2-(D-1-carboxyethyl)-L-arginine N2-[(1R)-1-carboxyethyl]-L-arginine arginine, N2-(1-carboxyethyl)-, L- arginine, N2-(1-carboxyethyl)-, L-arginine |
seedM:cpd02553 | Octopine Arginine, N2-(1-carboxyethyl)-, L- Arginine, N2-(1-carboxyethyl)-, L-arginine D-(+)-Octopine D-(+)-octopine D-Octopine D-octopine L-Arginine, N2-(1-carboxyethyl)-, (R)- L-Arginine, N2-[(1R)-1-carboxyethyl]- L-arginine, N2-(1-carboxyethyl)-, (R)- L-arginine, N2-[(1R)-1-carboxyethyl]- N2-(1-Carboxyethyl)-L-arginine N2-(1-carboxyethyl)-, (R)-L-arginine N2-(1-carboxyethyl)-L-arginine N2-(D-1-Carboxyethyl)-L-arginine N2-(D-1-carboxyethyl)-L-arginine N2-[(1R)-1-carboxyethyl]-L-Arginine N2-[(1R)-1-carboxyethyl]-L-arginine arginine, N2-(1-carboxyethyl)-, L- arginine, N2-(1-carboxyethyl)-, L-arginine octp |
chebi:15805 | D-octopine Arginine, N2-(1-carboxyethyl)-, L- D-(+)-Octopine D-Octopine L-Arginine, N2-(1-carboxyethyl)-, (R)- L-Arginine, N2-[(1R)-1-carboxyethyl]- N(2)-(D-1-carboxyethyl)-L-arginine N(2)-[(1R)-1-carboxyethyl]-L-arginine N2-(1-Carboxyethyl)-L-arginine N2-(D-1-Carboxyethyl)-L-arginine Octopine |
sabiorkM:7104 | N2-(1-Carboxyethyl)-L-arginine Arginine, N2-(1-carboxyethyl)-, L- D-(+)-Octopine D-Octopine L-Arginine, N2-(1-carboxyethyl)-, (R)- L-Arginine, N2-[(1R)-1-carboxyethyl]- Octopine |
biggM:octp | Octopine |
chebi:57520 | D-octopine (2S)-5-{[amino(iminio)methyl]amino}-2-{[(1R)-1-carboxylatoethyl]ammonio}pentanoate (2S)-5-{[amino(iminiumyl)methyl]amino}-2-{[(1R)-1-carboxylatoethyl]azaniumyl}pentanoate D-octopine dizwitterion |
chebi:67037 | D-octopine(1-) (2S)-5-[(ammoniocarbonoimidoyl)amino]-2-{[(1R)-1-carboxylatoethyl]amino}pentanoate |
biggM:M_octp chebi:12631 chebi:21810 chebi:7366 keggC:M_C04137 seedM:M_cpd02553 | secondary/obsolete/fantasy identifier |
keggC:C04137 | D-Octopine Arginine, N2-(1-carboxyethyl)-, L- D-(+)-Octopine L-Arginine, N2-(1-carboxyethyl)-, (R)- L-Arginine, N2-[(1R)-1-carboxyethyl]- N2-(1-Carboxyethyl)-L-arginine N2-(D-1-Carboxyethyl)-L-arginine Octopine |