3-indoxyl choline phosphate -molcms-06162607042D 20 21 0 0 0 0 0 0 0 0999 V2000 3.2388 0.6719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6723 -0.1522 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 1.7213 -0.4612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9781 0.2079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0827 1.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1691 1.6092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4901 0.8311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4155 -0.8213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3665 -0.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1097 -1.1814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0608 -0.8724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2687 0.1057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8039 -1.5416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0118 -0.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 4 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 7 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 M CHG 2 13 -1 17 1 M END > 3-indoxyl choline phosphate > 439809-44-6 > C13H19N2O4P > > 298.27 > > > > O=P(OC1=CNC2=C1C=CC=C2)([O-])OCC[N+](C)(C)C $$$$