(3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid

CAS Registry Number®

137433-06-8

CAS Name

(3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid

Molecular Formula

C11H20NO5P

Molecular Mass

277.25

Cite this Page

(3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=137433-06-8 (retrieved 2024-11-24) (CAS RN: 137433-06-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

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-/m0/s1

InChIKey

InChIKey=STIRHCNEGQQBOY-QEYWKRMJSA-N

SMILES

C(O)(=O)[C@@H]1C[C@@]2([C@@](CC[C@H](CP(=O)(O)O)C2)(CN1)[H])[H]

Canonical SMILES

O=C(O)C1NCC2CCC(CC2C1)CP(=O)(O)O

Other Names for this Substance

  • 3-Isoquinolinecarboxylic acid, decahydro-6-(phosphonomethyl)-, (3S,4aR,6S,8aR)-
  • 3-Isoquinolinecarboxylic acid, decahydro-6-(phosphonomethyl)-, [3S-(3α,4aα,6β,8aα)]-
  • (3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid
  • LY 235959
  • (3S,4AR,6S,8aR)-decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid

CAS INSIGHTSTM
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