RESIDUE 5JB 153 CONECT O17 1 C38 CONECT C38 3 O17 C37 C39 CONECT C37 3 C38 C36 H37 CONECT C39 4 C38 C40 H391 H392 CONECT C40 4 C39 C41 H401 H402 CONECT C41 4 C40 C42 C36 C43 CONECT C42 4 C41 H421 H422 H423 CONECT C36 3 C37 C41 C35 CONECT C35 4 C36 C34 H351 H352 CONECT C34 4 C35 C33 H341 H342 CONECT C43 4 C41 C33 C44 H43 CONECT C33 4 C34 C43 C32 H33 CONECT C44 4 C43 C45 H441 H442 CONECT C45 4 C44 C46 H451 H452 CONECT C46 4 C45 C47 C32 C29 CONECT C47 4 C46 H471 H472 H473 CONECT C32 4 C33 C46 C31 H32 CONECT C31 4 C32 C30 H311 H312 CONECT C30 4 C31 C29 H301 H302 CONECT C29 4 C46 C30 C1 H29 CONECT C1 4 C29 C C2 H1 CONECT C 4 C1 HC1 HC2 HC3 CONECT C2 4 C1 C3 H21C H22C CONECT C3 4 C2 C4 H31C H32C CONECT C4 4 C3 C5 H41C H42C CONECT C5 4 C4 C6 C7 H5 CONECT C6 4 C5 H61C H62C H63C CONECT C7 3 C5 O S1P CONECT O 1 C7 CONECT S1P 2 C7 C2P CONECT C2P 4 S1P C3P H2P1 H2P2 CONECT C3P 4 C2P N4P H3P1 H3P2 CONECT N4P 3 C3P C5P H4P CONECT O5P 1 C5P CONECT C5P 3 N4P O5P C6P CONECT C6P 4 C5P C7P H6P1 H6P2 CONECT C7P 4 C6P N8P H7P1 H7P2 CONECT N8P 3 C7P C9P H8P CONECT C9P 3 N8P O9P CAP CONECT O9P 1 C9P CONECT CAP 4 C9P OAP CBP HAP CONECT OAP 2 CAP HA CONECT CBP 4 CAP CDP CEP CCP CONECT CDP 4 CBP HDP1 HDP2 HDP3 CONECT CEP 4 CBP HEP1 HEP2 HEP3 CONECT CCP 4 CBP O6A HCP1 HCP2 CONECT O6A 2 CCP P2A CONECT P2A 4 O6A O4A O5A O3A CONECT O4A 2 P2A H4A CONECT O5A 1 P2A CONECT O3A 2 P2A P1A CONECT P1A 4 O3A O1A O2A O5B CONECT O1A 1 P1A CONECT O2A 2 P1A H2A CONECT O5B 2 P1A C5B CONECT C5B 4 O5B C4B H5B1 H5B2 CONECT C4B 4 C5B C3B O4B H4B CONECT C3B 4 C4B O3B C2B H3B CONECT O3B 2 C3B P3B CONECT P3B 4 O3B O9A O8A O7A CONECT O9A 1 P3B CONECT O8A 2 P3B H8A CONECT O7A 2 P3B H7A CONECT C2B 4 C3B O2B C1B H2B CONECT O2B 2 C2B HB CONECT O4B 2 C4B C1B CONECT C1B 4 C2B O4B N9A H1B CONECT N9A 3 C1B C4A C8A CONECT C4A 3 N9A N3A C5A CONECT N3A 2 C4A C2A CONECT C2A 3 N3A N1A HD CONECT C8A 3 N9A N7A HC CONECT N7A 2 C8A C5A CONECT C5A 3 C4A N7A C6A CONECT C6A 3 C5A N1A N6A CONECT N1A 2 C2A C6A CONECT H37 1 C37 CONECT H391 1 C39 CONECT H392 1 C39 CONECT H401 1 C40 CONECT H402 1 C40 CONECT H421 1 C42 CONECT H422 1 C42 CONECT H423 1 C42 CONECT H43 1 C43 CONECT H351 1 C35 CONECT H352 1 C35 CONECT H341 1 C34 CONECT H342 1 C34 CONECT H33 1 C33 CONECT H441 1 C44 CONECT H442 1 C44 CONECT H32 1 C32 CONECT H451 1 C45 CONECT H452 1 C45 CONECT H471 1 C47 CONECT H472 1 C47 CONECT H473 1 C47 CONECT H29 1 C29 CONECT H311 1 C31 CONECT H312 1 C31 CONECT H301 1 C30 CONECT H302 1 C30 CONECT H1 1 C1 CONECT HC1 1 C CONECT HC2 1 C CONECT HC3 1 C CONECT H21C 1 C2 CONECT H22C 1 C2 CONECT H31C 1 C3 CONECT H32C 1 C3 CONECT H41C 1 C4 CONECT H42C 1 C4 CONECT H5 1 C5 CONECT H61C 1 C6 CONECT H62C 1 C6 CONECT H63C 1 C6 CONECT H2P1 1 C2P CONECT H2P2 1 C2P CONECT H4P 1 N4P CONECT H7P1 1 C7P CONECT H7P2 1 C7P CONECT H8P 1 N8P CONECT HAP 1 CAP CONECT HA 1 OAP CONECT HDP1 1 CDP CONECT HDP2 1 CDP CONECT HDP3 1 CDP CONECT HEP1 1 CEP CONECT HEP2 1 CEP CONECT HEP3 1 CEP CONECT HCP1 1 CCP CONECT HCP2 1 CCP CONECT H4A 1 O4A CONECT H2A 1 O2A CONECT H5B1 1 C5B CONECT H5B2 1 C5B CONECT H4B 1 C4B CONECT H3B 1 C3B CONECT H2B 1 C2B CONECT H8A 1 O8A CONECT H7A 1 O7A CONECT HB 1 O2B CONECT H1B 1 C1B CONECT HC 1 C8A CONECT HD 1 C2A CONECT N6A 3 C6A H6A1 H6A2 CONECT H6A1 1 N6A CONECT H6A2 1 N6A CONECT H3P1 1 C3P CONECT H3P2 1 C3P CONECT H6P1 1 C6P CONECT H6P2 1 C6P END HET 5JB 153 HETNAM 5JB (25S)-3-oxocholest-4-en-26-oyl-CoA FORMUL 5JB C48 H76 N7 O18 P3 S1