RESIDUE 3HC 96 CONECT N1A 2 C2A C6A CONECT C2A 3 N1A N3A H2A CONECT N3A 2 C2A C4A CONECT C4A 3 N3A C5A N9A CONECT C5A 3 C4A C6A N7A CONECT C6A 3 N1A C5A N6A CONECT N6A 3 C6A H61A H62A CONECT N7A 2 C5A C8A CONECT C8A 3 N7A N9A H8A CONECT N9A 3 C4A C8A C1B CONECT C1B 4 N9A C2B O4B H1B CONECT C2B 4 C1B O2B C3B H2B CONECT O2B 2 C2B HO2A CONECT C3B 4 C2B O3B C4B H3B CONECT O3B 2 C3B P3B CONECT P3B 4 O3B O7A O8A O9A CONECT O7A 1 P3B CONECT O8A 2 P3B HOA8 CONECT O9A 2 P3B HOA9 CONECT C4B 4 C3B O4B C5B H4B CONECT O4B 2 C1B C4B CONECT C5B 4 C4B O5B H51A H52A CONECT O5B 2 C5B P1A CONECT P1A 4 O5B O1A O2A O3A CONECT O1A 1 P1A CONECT O2A 2 P1A HOA2 CONECT O3A 2 P1A P2A CONECT P2A 4 O3A O4A O5A O6A CONECT O4A 1 P2A CONECT O5A 2 P2A HOA5 CONECT O6A 2 P2A CCP CONECT CBP 4 CCP CDP CEP CAP CONECT CCP 4 O6A CBP H121 H122 CONECT CDP 4 CBP H131 H132 H133 CONECT CEP 4 CBP H141 H142 H143 CONECT CAP 4 CBP OAP C9P H10 CONECT OAP 2 CAP HO1 CONECT C9P 3 CAP O9P N8P CONECT O9P 1 C9P CONECT N8P 3 C9P C7P HN8 CONECT C7P 4 N8P C6P H71 H72 CONECT C6P 4 C7P C5P H61 H62 CONECT C5P 3 C6P O5P N4P CONECT O5P 1 C5P CONECT N4P 3 C5P C3P HN4 CONECT C3P 4 N4P C2P H31 H32 CONECT C2P 4 C3P S1P H21 H22 CONECT S1P 2 C2P C1 CONECT C1 3 S1P O1 C2 CONECT O1 1 C1 CONECT C2 4 C1 C3 HC21 HC22 CONECT C3 4 C2 O3 C4 HC31 CONECT O3 2 C3 HO31 CONECT C4 4 C3 HC41 HC42 HC43 CONECT H2A 1 C2A CONECT H61A 1 N6A CONECT H62A 1 N6A CONECT H8A 1 C8A CONECT H1B 1 C1B CONECT H2B 1 C2B CONECT HO2A 1 O2B CONECT H3B 1 C3B CONECT HOA8 1 O8A CONECT HOA9 1 O9A CONECT H4B 1 C4B CONECT H51A 1 C5B CONECT H52A 1 C5B CONECT HOA2 1 O2A CONECT HOA5 1 O5A CONECT H121 1 CCP CONECT H122 1 CCP CONECT H131 1 CDP CONECT H132 1 CDP CONECT H133 1 CDP CONECT H141 1 CEP CONECT H142 1 CEP CONECT H143 1 CEP CONECT H10 1 CAP CONECT HO1 1 OAP CONECT HN8 1 N8P CONECT H71 1 C7P CONECT H72 1 C7P CONECT H61 1 C6P CONECT H62 1 C6P CONECT HN4 1 N4P CONECT H31 1 C3P CONECT H32 1 C3P CONECT H21 1 C2P CONECT H22 1 C2P CONECT HC21 1 C2 CONECT HC22 1 C2 CONECT HC31 1 C3 CONECT HO31 1 O3 CONECT HC41 1 C4 CONECT HC42 1 C4 CONECT HC43 1 C4 END HET 3HC 96 HETSYN 3HC 3-HYDROXYBUTYRYL-COENZYME A HETNAM 3HC 3-HYDROXYBUTANOYL-COENZYME A FORMUL 3HC C25 H42 N7 O18 P3 S1