(3R,4aS,6R,8aS)-6-(phosphonomethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid

Systemtic Name: (3R,4aS,6R,8aS)-6-(phosphonomethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid Openeye Name: (3R,4aS,6R,8aS)-6-(phosphonomethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid CAS Name: (3R,4aS,6R,8aS)-6-(phosphonomethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid IUPAC Name: (3R,4aS,6R,8aS)-6-(phosphonomethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid Traditional Name: (3R,4aS,6R,8aS)-6-(phosphonomethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid Formula: C11H20NO5P MolecularWeight: 277.253961

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CNC(CC2CC1CP(=O)(O)O)C(=O)O

Isomeric SMILES

C1C[C@@H]2CN[C@H](C[C@@H]2C[C@@H]1CP(=O)(O)O)C(=O)O

InChI

InChI=1S/C11H20NO5P/c13-11(14)10-4-9-3-7(6-18(15,16)17)1-2-8(9)5-12-10/h7-10,12H,1-6H2,(H,13,14)(H2,15,16,17)/t7-,8-,9+,10-/m1/s1