CDK 1030232203 43 47 0 0 0 0 0 0 0 0999 V2000 7.1449 -1.2375 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.4304 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7159 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4304 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7159 -2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0014 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1449 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7159 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0014 -2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0014 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8594 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 0.3401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1903 0.4487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -3.3001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -3.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4529 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -0.4327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 2.8876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 2.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.8876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 2 0 0 0 0 7 12 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 16 19 1 0 0 0 0 16 20 2 0 0 0 0 17 21 1 0 0 0 0 17 22 2 0 0 0 0 18 23 1 0 0 0 0 20 24 1 0 0 0 0 20 25 1 0 0 0 0 21 26 2 0 0 0 0 23 27 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 30 1 0 0 0 0 25 31 1 0 0 0 0 29 32 2 0 0 0 0 29 33 1 0 0 0 0 30 34 1 0 0 0 0 30 35 1 0 0 0 0 31 36 1 0 0 0 0 32 37 1 0 0 0 0 32 38 1 0 0 0 0 33 39 2 0 0 0 0 36 40 2 0 0 0 0 36 41 1 0 0 0 0 38 42 2 0 0 0 0 42 43 1 0 0 0 0 8 11 1 0 0 0 0 18 22 1 0 0 0 0 21 25 1 0 0 0 0 30 33 1 0 0 0 0 39 42 1 0 0 0 0 M END > CHEBI:226140 > Naphthacemycin C2 > 2 > 1-(3-chloro-2,4-dimethoxy-6-methylphenyl)-8,10,12-trihydroxy-3-methoxy-6,6-dimethyl-5a-(2-oxopropyl)tetracene-5,11-dione > C33H31ClO9 > 607.050 > 606.16566 > 0 > ClC1=C(OC)C(C2=C3C(O)=C4C(=O)C5=C(O)C=C(O)C=C5C(C4(CC(=O)C)C(C3=CC(=C2)OC)=O)(C)C)=C(C)C=C1OC > InChI=1S/C33H31ClO9/c1-14-8-22(42-6)27(34)30(43-7)23(14)18-11-17(41-5)12-19-24(18)28(38)26-29(39)25-20(9-16(36)10-21(25)37)32(3,4)33(26,31(19)40)13-15(2)35/h8-12,36-38H,13H2,1-7H3 > WHAQJIMGNIEYFC-UHFFFAOYSA-N $$$$