Mrv0541 05061310342D 11 10 0 0 0 0 999 V2000 1.3480 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0625 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6349 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3493 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6349 0.5230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0638 -0.3020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3493 -1.5395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4914 -0.7145 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2059 -0.3020 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 2 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 5 1 0 0 0 0 8 6 2 0 0 0 0 9 6 1 0 0 0 0 10 3 1 0 0 0 0 11 4 1 0 0 0 0 11 10 1 0 0 0 0 M END > NP0049190 > NP-MRD > NC(CSSCC=C)C(O)=O > InChI=1S/C6H11NO2S2/c1-2-3-10-11-4-5(7)6(8)9/h2,5H,1,3-4,7H2,(H,8,9) > WYQZZUUUOXNSCS-UHFFFAOYSA-N > C6H11NO2S2 > 193.287 > 193.023119981 > 3 > 19.501302912574317 > 1 > 2 > 0 > 0 > 2-amino-3-(prop-2-en-1-yldisulfanyl)propanoic acid > -1.78 > -1.5677720687042562 > -1.89 > 0 > 0 > 0 > 2.2577924651929506 > 9.039819655444251 > 63.32000000000001 > 50.144400000000005 > 6 > 1 > 2.48e+00 g/l > 2-amino-3-(prop-2-en-1-yldisulfanyl)propanoic acid > 0 > NP0049190 > S-(Allylthio)-L-cysteine $$$$