Marvin 08181015132D 28 27 0 0 1 0 999 V2000 13.8784 -14.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1638 -14.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5927 -14.1305 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4494 -14.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3072 -14.5430 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.0217 -14.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5927 -13.3056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7361 -14.5430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4506 -13.3056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4506 -14.9555 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 17.4506 -14.1305 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 18.1649 -14.5430 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 15.3073 -15.3680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8783 -15.3680 0.0000 R# 0 0 0 0 0 0 0 0 0 0 0 0 14.5927 -15.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5927 -16.6056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5914 -14.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8768 -14.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0204 -14.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3058 -14.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7348 -14.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8763 -13.3095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5905 -12.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3076 -13.3095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0233 -12.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7390 -13.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4546 -12.9119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1703 -13.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 7 1 1 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 5 13 1 6 0 0 0 5 6 1 0 0 0 0 6 8 1 0 0 0 0 8 11 1 0 0 0 0 11 9 2 0 0 0 0 11 10 1 0 0 0 0 11 12 1 0 0 0 0 13 15 1 0 0 0 0 15 14 1 0 0 0 0 15 16 2 0 0 0 0 18 17 1 0 0 0 0 20 19 1 0 0 0 0 17 20 1 0 0 0 0 21 4 1 0 0 0 0 19 21 1 0 0 0 0 18 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 2 10 -1 12 -1 M END > CHEBI:57674 > N-acylsphingosine 1-phosphate(2-) > The dianion formed by deprotonation of both phosphate OH groups in any N-acylsphingosine 1-phosphate. > 3 > ceramide 1-phosphate(2-); an N-acylsphing-4-enine 1-phosphate > C19H35NO6PR > 404.459 > 404.22020 > -2 > CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](COP([O-])([O-])=O)NC([*])=O $$$$