Ketcher 07151517002D 1 1.00000 0.00000 0 48 51 0 1 0 999 V2000 12.8713 -2.6756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8628 -1.6563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7390 -2.1701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8713 -3.6779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0036 -2.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7432 -4.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1401 -2.6756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0036 -1.1761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7432 -5.1733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6025 -3.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1401 -3.6779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2724 -2.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8713 -5.6746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5983 -5.6746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2724 -4.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8713 -6.6728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0036 -5.1733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2724 -5.1733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4090 -3.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7432 -7.1700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0036 -7.1700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1401 -5.6746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4047 -5.6788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1401 -6.6728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0036 -8.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2724 -7.1700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7412 -8.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8687 -8.6704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6028 -8.6686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8724 -9.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6028 -9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7303 -10.1671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0094 -10.1662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4643 -10.1653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7339 -11.1613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1443 -9.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4643 -6.1710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3268 -5.6698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4680 -7.1685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1930 -6.1665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3201 -4.6607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3304 -7.6629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1930 -7.1619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0554 -5.6655 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.0445 -4.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9180 -6.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3332 -8.6611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0044 -4.1810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 1 0 0 1 4 1 0 0 0 1 5 1 0 0 0 4 6 1 0 0 0 5 7 1 0 0 0 5 8 2 0 0 0 6 9 1 0 0 0 6 10 1 6 0 0 7 11 1 0 0 0 7 12 1 1 0 0 9 13 1 0 0 0 9 14 1 6 0 0 11 15 1 0 0 0 13 16 1 0 0 0 13 17 1 6 0 0 15 18 1 0 0 0 15 19 1 6 0 0 16 20 1 6 0 0 16 21 1 0 0 0 18 22 1 0 0 0 18 23 1 6 0 0 21 24 1 0 0 0 21 25 1 1 0 0 24 26 2 0 0 0 2 3 1 0 0 0 22 24 1 0 0 0 27 28 1 0 0 0 27 29 1 0 0 0 28 30 1 0 0 0 29 31 1 0 0 0 30 32 1 0 0 0 30 33 1 1 0 0 31 34 1 1 0 0 32 35 1 6 0 0 33 36 1 0 0 0 31 32 1 0 0 0 27 20 1 6 0 0 37 38 1 0 0 0 37 39 1 0 0 0 38 40 1 0 0 0 38 41 1 6 0 0 39 42 1 0 0 0 40 43 1 0 0 0 40 44 1 1 0 0 44 45 1 0 0 0 44 46 1 0 0 0 42 43 1 0 0 0 42 47 1 1 0 0 37 14 1 1 0 0 11 48 1 1 0 0 M END > CHEBI:16869 > oleandomycin > 3 > CHEBI:7737; CHEBI:14682; CHEBI:25659 > Romicil; Oleandomycin; Matromycin; Landomycin; Amimycin > (3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside > C35H61NO12; C35H61NO12 > 687.85830 > 687.41938 > 0 > CO[C@H]1C[C@H](O[C@H]2[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@@H](C)C[C@@]3(CO3)C(=O)[C@H](C)[C@@H](O)[C@@H](C)[C@@H](C)OC(=O)[C@@H]2C)O[C@@H](C)[C@@H]1O > InChI=1S/C35H61NO12/c1-16-14-35(15-43-35)32(40)19(4)27(37)18(3)22(7)46-33(41)21(6)31(47-26-13-25(42-11)28(38)23(8)45-26)20(5)30(16)48-34-29(39)24(36(9)10)12-17(2)44-34/h16-31,34,37-39H,12-15H2,1-11H3/t16-,17+,18-,19+,20+,21+,22+,23-,24-,25-,26-,27-,28-,29+,30-,31-,34-,35+/m0/s1 > RZPAKFUAFGMUPI-QESOVKLGSA-N > 74476 > 3922-90-5 > 3922-90-5 > C01946 > LMPK04000007 > OLEANDOMYCIN $$$$