LMPR01070950 LIPID_MAPS_STRUCTURE_DATABASE 55 56 0 0 0 999 V2000 2.6298 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6298 -14.4084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4981 -14.9097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3665 -14.4084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3665 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4981 -12.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2528 -12.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1212 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9895 -12.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8578 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7263 -12.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5946 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4628 -12.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3311 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1994 -12.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0679 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9362 -12.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8046 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6729 -12.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5412 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4095 -12.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2779 -13.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9968 -12.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9994 -12.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2482 -14.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1414 -12.9071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9952 -13.4001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8468 -12.9086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6994 -13.4008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5678 -12.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5679 -11.8969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7152 -11.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8469 -11.9060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2779 -14.4084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8046 -14.4084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9895 -11.9017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4628 -11.9018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9860 -11.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1988 -14.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2000 -14.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7618 -14.9094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1212 -14.3887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4565 -11.3839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 -11.4046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 -10.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7428 -9.8883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9924 -9.9079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5911 -10.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4581 -9.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3251 -10.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1921 -9.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0486 -10.3780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8984 -9.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7499 -10.3791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6007 -9.8880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 2 0 0 0 5 6 1 0 0 0 1 6 1 0 0 0 5 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 2 0 0 0 10 11 1 0 0 0 11 12 2 0 0 0 12 13 1 0 0 0 13 14 2 0 0 0 14 15 1 0 0 0 15 16 2 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 20 21 1 0 0 0 21 22 2 0 0 0 6 23 1 0 0 0 6 24 1 0 0 0 4 25 1 0 0 0 22 26 1 0 0 0 26 27 2 0 0 0 28 27 1 1 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 32 33 2 0 0 0 28 33 1 0 0 0 22 34 1 0 0 0 18 35 1 0 0 0 9 36 1 0 0 0 13 37 1 0 0 0 33 38 1 0 0 0 29 39 1 0 0 0 29 40 1 0 0 0 2 41 1 1 0 0 8 42 2 0 0 0 31 43 1 6 0 0 36 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 45 47 2 0 0 0 46 48 2 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 M END > LMPR01070950 > Siphonaxanthin decenoate > (3R,3'R,6'R)-19-(trans-Dec-2-enoyloxy)-3,3'-dihydroxy-7,8-dihydro-beta,epsilon-caroten-8-one > C50H72O5 > 752.54 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > XMQHQSCSYZPBNB-AIZNKAMTSA-N > InChI=1S/C50H72O5/c1-11-12-13-14-15-16-17-28-48(54)55-36-42(47(53)33-46-41(6)32-44(52)35-50(46,9)10)27-21-26-38(3)23-19-18-22-37(2)24-20-25-39(4)29-30-45-40(5)31-43(51)34-49(45,7)8/h17-31,43-45,51-52H,11-16,32-36H2,1-10H3/b19-18+,24-20+,26-21+,28-17+,30-29+,37-22+,38-23+,39-25+,42-27+/t43-,44+,45-/m0/s1 > C1C(C)(C)C(CC(=O)/C(/COC(=O)/C=C/CCCCCCC)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/[C@H]2C(C)=C[C@H](O)CC2(C)C)=C(C)C[C@H]1O > - > - > - > - > - > - > 163049345 > - > - > - > - > - > 36894 > - $$$$