HMDB0041244 RDKit 3D Soyasapogenol B 3-O-[a-L-rhamnosyl-(1->4)-b-D-galactosyl-(1->4)-b-D-glucuronide] 144151 0 0 0 0 0 0 0 0999 V2000 11.1601 1.9456 -0.8058 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4307 1.1957 -1.1992 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0859 -0.0075 -1.7285 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3759 -0.8806 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1522 -0.3464 -0.6513 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0603 -1.0170 -1.1061 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1257 -0.2621 -1.9791 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4253 -1.2879 -2.8797 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7221 -0.6935 -3.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2428 0.5780 -1.3855 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5515 0.1643 -0.2897 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4465 -0.6140 -0.5109 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2474 -0.0200 -0.1126 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6116 -0.8429 0.9388 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7833 -0.1354 2.2541 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8349 0.5015 2.5153 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8107 -0.1601 3.2082 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4023 -1.3944 0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5324 -0.8870 -0.1237 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 0.2469 0.2512 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5276 0.1583 0.2191 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0392 1.1479 -0.8032 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5308 0.8529 -0.9192 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2944 1.1337 0.3437 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2336 2.6589 0.5403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 0.4618 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3350 -0.8676 1.8162 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7978 -0.9222 1.8027 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5152 0.3350 1.3266 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5187 1.2533 2.5419 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7178 0.7961 0.1685 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8437 -0.2988 -0.8975 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3074 -0.3783 -1.2958 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2742 -0.1868 -0.4353 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6676 -0.2707 -0.8981 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3898 -1.5379 -0.9218 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5968 -1.3344 -1.8124 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5898 -2.4367 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1661 -1.6505 -3.2513 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2650 -0.0397 -1.8072 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4690 1.1986 -1.4667 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3709 2.1704 -1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5479 0.7970 -0.2836 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5099 0.4142 0.7564 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6212 1.8665 0.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6832 1.4428 1.2426 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9493 0.1317 0.9692 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4243 -0.9707 1.8891 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1918 0.3537 1.5521 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8377 -0.8806 2.4075 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4657 1.4595 2.2954 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4413 2.6718 1.6701 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2754 -0.7496 -1.4337 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -0.5259 -2.5405 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3736 0.2821 -1.3154 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1717 0.2034 -2.4465 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4924 -0.4019 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3034 0.6312 1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2827 -1.5179 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1924 -2.0173 1.0139 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1407 -1.0701 0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2526 -2.4059 0.7235 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5054 -0.4187 0.3019 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0231 -0.4854 1.6065 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3018 1.0514 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5630 1.5938 -0.2143 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8778 1.6730 0.2121 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3435 1.7893 -1.5166 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3719 3.0393 -0.8035 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9974 1.8198 -1.9365 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3185 -1.8311 -1.5193 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4047 -1.9194 -1.6521 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 0.3719 -2.7441 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2406 -1.8984 -3.3429 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8225 -1.9925 -2.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3789 -1.4049 -4.4793 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1529 1.1186 0.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 0.9834 0.3006 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3041 -1.7732 1.1149 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9776 0.0124 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