Marvin 09101216472D 52 61 0 0 0 0 999 V2000 0.5749 -17.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3696 -17.3299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -16.9907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1704 -16.1885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5331 -15.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1603 -16.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8443 -17.0555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9655 -15.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5635 -16.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2872 -16.1270 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1364 -15.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3196 -15.2105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9631 -16.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1978 -15.3094 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5313 -16.7001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -18.3637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4136 -18.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9673 -17.8993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0327 -16.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0982 -17.3049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7126 -16.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6999 -14.6557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4688 -16.3341 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7834 -15.1877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5882 -15.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0092 -15.7099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8295 -15.6976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2299 -14.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9807 -15.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4027 -15.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7009 -15.4276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1271 -15.3971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3833 -14.1734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6579 -13.7777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -12.9655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6295 -12.8592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9837 -13.6057 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9849 -14.2884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8007 -14.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0373 -13.4913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3678 -13.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7175 -13.5175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2428 -12.3657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9574 -14.2111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1721 -13.9763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7681 -13.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 -16.4064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8509 -17.1275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0553 -14.9645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8173 -13.2207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4417 -13.7608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9729 -12.4099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23 26 1 0 0 0 0 25 24 1 0 0 0 0 24 21 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 25 26 2 0 0 0 0 12 8 1 0 0 0 0 26 27 1 0 0 0 0 8 4 1 0 0 0 0 27 28 2 0 0 0 0 28 39 1 0 0 0 0 38 25 1 0 0 0 0 6 13 1 0 0 0 0 29 44 1 0 0 0 0 44 34 1 0 0 0 0 4 5 1 0 0 0 0 33 30 1 0 0 0 0 13 14 1 0 0 0 0 30 31 1 0 0 0 0 31 29 2 0 0 0 0 5 6 2 0 0 0 0 30 32 2 0 0 0 0 33 34 2 0 0 0 0 13 15 2 0 0 0 0 6 7 1 0 0 0 0 1 16 1 0 0 0 0 7 3 1 0 0 0 0 16 17 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 37 33 1 0 0 0 0 38 39 2 0 0 0 0 8 9 2 0 0 0 0 2 18 1 0 0 0 0 3 4 2 0 0 0 0 10 19 1 0 0 0 0 3 1 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 38 1 0 0 0 0 19 20 2 0 0 0 0 35 43 1 0 0 0 0 45 44 1 0 0 0 0 46 45 1 0 0 0 0 44 46 1 0 0 0 0 19 21 1 0 0 0 0 14 22 1 0 0 0 0 1 2 2 0 0 0 0 27 47 1 0 0 0 0 22 45 1 0 0 0 0 47 48 1 0 0 0 0 29 14 1 0 0 0 0 28 49 1 0 0 0 0 21 23 1 0 0 0 0 40 50 1 0 0 0 0 2 9 1 0 0 0 0 50 51 2 0 0 0 0 9 10 1 0 0 0 0 50 52 1 0 0 0 0 M END > CHEBI:65964 > gilvusmycin > An antibiotic isolated from the culture broth of Streptomyces sp. QM16 with potent cytotoxic activity against the human tumor cells. > 3 > 6-({6-[(6-acetyl-5-hydroxy-4-methoxy-3,6,7,8-tetrahydropyrrolo[3,2-e]indol-2-yl)carbonyl]-5-hydroxy-4-methoxy-3,6,7,8-tetrahydropyrrolo[3,2-e]indol-2-yl}carbonyl)-3-methyl-4,4a,5,6-tetrahydrocyclopropa[c]pyrrolo[3,2-e]indol-8(1H)-one > C38H34N6O8 > 702.71200 > 702.24381 > 0 > COc1c(O)c2N(CCc2c2cc([nH]c12)C(=O)N1CCc2c1c(O)c(OC)c1[nH]c(cc21)C(=O)N1CC2CC22C1=CC(=O)c1[nH]cc(C)c21)C(C)=O > InChI=1S/C38H34N6O8/c1-15-13-39-29-24(46)11-25-38(26(15)29)12-17(38)14-44(25)37(50)23-10-21-19-6-8-43(31(19)33(48)35(52-4)28(21)41-23)36(49)22-9-20-18-5-7-42(16(2)45)30(18)32(47)34(51-3)27(20)40-22/h9-11,13,17,39-41,47-48H,5-8,12,14H2,1-4H3 > XUBJLJZOSKJNMY-UHFFFAOYSA-N > 8382539 > 10348041 $$$$