HMDB0032501 RDKit 3D Santalyl acetate 45 46 0 0 0 0 0 0 0 0999 V2000 -2.3611 2.2248 0.2557 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 0.9233 0.2682 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8799 0.3502 0.6683 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6391 -0.1128 -0.5549 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -1.2004 -1.0746 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6327 -1.3699 -0.0388 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4416 -0.9945 1.2077 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6359 -0.1960 -0.0588 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0525 -0.1817 -1.4291 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6108 -0.5106 0.9641 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 0.6060 1.3277 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1671 1.1201 0.2567 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4747 1.0846 0.1417 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0856 1.7110 -1.1118 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3184 0.5013 1.1982 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0639 -0.5627 0.7665 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 -0.7009 -0.0742 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7194 -2.0547 -0.3738 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5942 0.2982 -0.6337 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1447 2.8975 0.5263 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4133 2.6266 -0.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4331 0.9615 1.3516 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5513 -0.6152 -0.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8211 0.6753 -1.2804 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2455 -2.1780 -1.1283 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3889 -0.8718 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1572 -2.3274 0.0292 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8733 -0.9360 2.1206 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3055 -1.6983 1.2546 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0538 -0.4311 -1.4229 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1436 0.7952 -1.9237 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4535 -1.0158 -2.0826 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0702 -1.2908 0.4863 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9378 -0.9712 1.8887 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9618 0.1929 2.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2301 1.4344 1.8559 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6348 1.6298 -0.5761 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3128 2.4129 -1.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3658 0.9597 -1.8536 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9274 2.3217 -0.7711 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0009 1.3820 1.5018 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7429 0.1983 2.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1526 -2.0053 -1.3824 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5363 -2.2331 0.3614 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -2.8493 -0.2679 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 3 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 17 19 2 0 8 2 1 0 7 3 1 0 1 20 1 0 1 21 1 0 3 22 1 0 4 23 1 0 4 24 1 0 5 25 1 0 5 26 1 0 6 27 1 0 7 28 1 0 7 29 1 0 9 30 1 0 9 31 1 0 9 32 1 0 10 33 1 0 10 34 1 0 11 35 1 0 11 36 1 0 12 37 1 0 14 38 1 0 14 39 1 0 14 40 1 0 15 41 1 0 15 42 1 0 18 43 1 0 18 44 1 0 18 45 1 0 M END