Mol:EEL3026
Copyright: ARM project http://www.metabolome.jp/
57 56 0 0 0 0 0 0 0 0999 V2000 -5.8920 -1.6388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5534 -0.1689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0705 0.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3953 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6398 2.6240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 0.7732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4098 1.7286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7726 2.1551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 2.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3441 2.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6298 2.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9153 2.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 2.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4865 2.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2277 2.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9423 2.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6566 2.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 2.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0853 2.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7996 2.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5138 2.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2283 2.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1618 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4476 0.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7333 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0191 0.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3048 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5903 0.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1239 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8385 0.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5528 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2674 0.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9816 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 0.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1246 0.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8389 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3441 1.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4865 1.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 1.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2283 1.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7333 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1239 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9816 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8389 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9427 2.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5534 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9068 -1.6388 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -4.9068 -0.6536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9068 -2.6240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9218 -1.6388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2073 -1.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4928 -1.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7783 -1.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0639 -1.6388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7783 -0.4013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4928 -2.4638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 3 7 1 0 3 6 1 0 8 5 1 0 9 8 1 0 10 9 1 0 11 10 1 0 12 11 1 0 13 12 1 0 14 13 1 0 15 14 1 0 16 15 1 0 17 16 1 0 18 17 1 0 19 18 1 0 20 19 1 0 21 20 1 0 22 21 1 0 24 23 1 0 25 24 1 0 26 25 1 0 27 26 1 0 28 27 1 0 29 28 1 0 30 29 1 0 31 30 1 0 32 31 1 0 33 32 1 0 34 33 1 0 35 34 1 0 36 35 1 0 37 36 1 0 6 23 1 0 10 38 1 0 14 39 1 0 18 40 1 0 22 41 1 0 25 42 1 0 29 43 1 0 33 44 1 0 37 45 1 0 22 46 1 0 37 47 1 0 1 48 1 0 48 49 2 0 48 50 1 0 48 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 54 56 2 0 53 57 1 0
S SKP 6 AUTODRAW FALSE ID EEL3026 FORMULA C46H94NO8P EXACTMASS 819.671705499 AVERAGEMASS 820.214261 SMILES C(CCCC(CCCC(CCCC(CCOCC(OCCC(C)CCCC(CCCC(C)CCCC(C)C)C)(COP(OCC(N)C(O)=O)(O)=O)[H])C)C)C)(C)C M END
