Mrv1652309092221532D 18 19 0 0 1 0 999 V2000 2.4366 0.8327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8491 0.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6615 0.2615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -0.1510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6582 -0.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -1.7015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 -2.2318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7832 -1.9496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6615 -2.1140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8048 -2.9264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8491 -1.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3188 -1.3387 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3188 -0.5137 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4938 -0.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4938 -1.3387 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6915 -1.5313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3012 -2.1409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8996 -2.7088 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 11 1 1 0 0 0 12 13 1 0 0 0 0 2 13 1 0 0 0 0 13 14 1 1 0 0 0 14 15 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 6 0 0 0 15 17 1 1 0 0 0 17 18 1 0 0 0 0 M END > NP0289615 > NP-MRD > C[C@]1(CO)C[C@@H]2[C@H]1CC(=O)\C(CO)=C/CCC2=C > InChI=1S/C15H22O3/c1-10-4-3-5-11(8-16)14(18)6-13-12(10)7-15(13,2)9-17/h5,12-13,16-17H,1,3-4,6-9H2,2H3/b11-5-/t12-,13+,15+/m0/s1 > YFJGKPLRMWQNGT-UUEOHABQSA-N > C15H22O3 > 250.338 > 250.156894568 > 3 > 40 > 27.687716788702204 > 1 > 2 > 0 > 1 > (1R,4Z,9R,11S)-4,11-bis(hydroxymethyl)-11-methyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one > 1.2904837170000008 > 0 > 2 > 0 > 18.231922456047027 > 14.971447531665007 > -1.3851394621231776 > 57.53 > 71.695 > 2 > 1 > (1R,4Z,9R,11S)-4,11-bis(hydroxymethyl)-11-methyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one > 0 > NP0289615 > (1r,4z,9r,11s)-4,11-bis(hydroxymethyl)-11-methyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one $$$$