LMPR0106040011 LIPID_MAPS_STRUCTURE_DATABASE 41 44 0 0 0 999 V2000 7.5904 8.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5904 7.8684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4765 7.3570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3626 7.8684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3626 8.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4765 9.4032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1345 7.8684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1345 8.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2484 9.4032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0206 9.4032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0206 10.4264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1345 10.9380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2484 10.4264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9937 9.0870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5950 9.9149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9937 10.7426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9439 11.9647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8300 12.4764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7159 11.9647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3626 9.9149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2484 8.6143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0206 8.6354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0206 11.3003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1345 9.6644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4765 6.3338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7043 7.3570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3376 7.1193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6182 9.9149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3416 9.1913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8300 8.3053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3648 9.1913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8300 13.4995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0578 12.4764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1718 11.9647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2857 12.4764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3998 11.9647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5137 12.4764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8881 11.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2484 7.3570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2484 6.3611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9968 7.3706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 9 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 11 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 5 20 1 1 0 0 0 9 21 1 1 0 0 0 10 22 1 1 0 0 0 11 23 1 6 0 0 0 8 24 1 6 0 0 0 3 25 1 6 0 0 0 2 26 1 6 0 0 0 4 27 1 6 0 0 0 15 28 1 1 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 18 32 2 0 0 0 0 17 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 39 7 1 0 0 0 0 4 39 1 0 0 0 0 39 40 1 6 0 0 7 41 1 1 0 0 M END > LMPR0106040011 > Monodesacetyl cephalosporin P1 > 16beta-acetoxy-3alpha,7beta,6alpha-trihydroxyfusida-17(20)Z,24-diene-21-oic acid > C31H48O7 > 532.34 > Prenol Lipids [PR] > Isoprenoids [PR01] > C30 isoprenoids (triterpenes) [PR0106] > Prostostane and fusidane triterpenoids [PR010604] > > QXLOOBQIYRMRDB-XRNAGEJKSA-N > InChI=1S/C31H48O7/c1-16(2)9-8-10-19(28(36)37)24-20-11-12-23-29(5)14-13-21(33)17(3)25(29)26(34)27(35)31(23,7)30(20,6)15-22(24)38-18(4)32/h9,17,20-23,25-27,33-35H,8,10-15H2,1-7H3,(H,36,37)/b24-19-/t17-,20+,21-,22+,23+,25-,26-,27+,29-,30+,31-/m1/s1 > C1C[C@]2(C)[C@]3([H])CC[C@@]4([H])/C(=C(\CC/C=C(\C)/C)/C(=O)O)/[C@@H](OC(C)=O)C[C@]4(C)[C@@]3(C)[C@@H](O)[C@H](O)[C@@]2([H])[C@H](C)[C@@H]1O > - > - > - > - > - > - > 155925976 > - > - > - > - > - > 5044 > - $$$$