Mrv1652304282213112D 27 33 0 0 1 0 999 V2000 -0.2620 -3.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4176 -3.1107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2063 -2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9857 -2.8412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1413 -3.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5175 -4.1913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9763 -4.1074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7315 -3.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4401 -2.5172 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6621 -2.3531 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5689 -3.1588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -3.8225 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3235 -3.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1819 -2.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -1.8262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5897 -2.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7312 -2.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0982 -3.4517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4056 -4.2173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2287 -4.1615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4300 -3.3614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8237 -3.6442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8126 -3.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4371 -1.6922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2362 -3.0084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5865 -3.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9844 -4.3193 0.0000 O 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 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 4 10 1 0 0 0 0 10 11 1 1 0 0 0 12 11 1 1 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 9 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 13 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 17 21 1 0 0 0 0 12 22 1 0 0 0 0 8 22 1 1 0 0 0 11 23 1 0 0 0 0 9 24 1 6 0 0 0 2 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 1 27 1 0 0 0 0 M END > NP0066970 > NP-MRD > CN1[C@H]2O[C@H]3CC4=CC5=C(OCO5)C=C4[C@@H]1[C@@]3(C)C1=C2C2=C(OCO2)C=C1 > InChI=1S/C21H19NO5/c1-21-12-3-4-13-18(26-9-23-13)17(12)20-22(2)19(21)11-7-15-14(24-8-25-15)5-10(11)6-16(21)27-20/h3-5,7,16,19-20H,6,8-9H2,1-2H3/t16-,19+,20-,21-/m0/s1 > MARJZNJEWWKEKF-CZGNIMDHSA-N > C21H19NO5 > 365.385 > 365.126322716 > 6 > 46 > 38.33912404493793 > 1 > 0 > 0 > 1 > (1R,12S,14S,24R)-24,25-dimethyl-5,7,13,17,19-pentaoxa-25-azaheptacyclo[12.10.1.0^{2,10}.0^{4,8}.0^{12,24}.0^{15,23}.0^{16,20}]pentacosa-2,4(8),9,15(23),16(20),21-hexaene > 2.66 > 3.3445759386666665 > -3.20 > 0 > 7 > 0 > 2.9003110655716244 > 49.39 > 94.87090000000002 > 0 > 1 > 2.28e-01 g/l > (1R,12S,14S,24R)-24,25-dimethyl-5,7,13,17,19-pentaoxa-25-azaheptacyclo[12.10.1.0^{2,10}.0^{4,8}.0^{12,24}.0^{15,23}.0^{16,20}]pentacosa-2,4(8),9,15(23),16(20),21-hexaene > 0 > NP0066970 > Corynoloxine $$$$