HMDB0038515 RDKit 3D L-gamma-Glutamyl-S-allylthio-L-cysteine 38 37 0 0 0 0 0 0 0 0999 V2000 -6.6572 0.1064 0.7649 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0149 -0.9388 0.2738 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8574 -0.7592 -0.6318 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6102 1.0429 -0.8431 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9952 1.3902 -2.0842 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4511 1.6206 -1.3066 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8497 0.5468 -0.4782 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5027 1.0668 -0.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6738 0.3855 -0.5321 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5071 -0.6372 -1.2131 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9689 0.9664 -0.1196 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1849 0.2283 -0.4794 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3899 -1.1379 0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4206 -2.1251 -0.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6493 -1.1606 1.5229 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0561 -1.9707 2.2712 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5482 -0.2944 2.1178 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4966 0.3358 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7516 -0.1686 1.7598 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7634 0.6274 1.1756 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5114 -0.0242 1.4332 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3889 1.1337 0.5448 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3323 -1.9411 0.5318 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1683 -1.2078 -1.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9559 -1.2890 -0.3341 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4664 2.5476 -0.6175 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 1.8557 -2.1052 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6892 -0.3552 -1.0459 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5642 1.9117 0.4549 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9347 1.2920 0.9462 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 1.9563 -0.6742 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2823 0.1689 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0693 0.8533 -0.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3593 -1.4977 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5295 -2.5122 -1.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4612 -2.9088 0.3962 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5125 -0.4970 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0115 1.3891 1.7771 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 7 18 1 0 18 19 2 0 18 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 6 26 1 0 6 27 1 0 7 28 1 0 8 29 1 0 11 30 1 0 11 31 1 0 12 32 1 0 12 33 1 0 13 34 1 0 14 35 1 0 14 36 1 0 17 37 1 0 20 38 1 0 M END