Mrv0541 10281316042D 42 47 0 0 0 0 999 V2000 2.5829 -4.8069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2474 -5.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0979 -4.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4269 -5.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2774 -4.2257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9419 -4.9794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4034 -4.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 -5.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8607 -6.1126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9554 -4.2800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7623 -4.4515 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3754 -3.8994 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0981 -5.2051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 -4.3118 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9186 -5.1188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4707 -5.7319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3754 -3.0744 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0899 -2.6620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8043 -3.8994 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8043 -3.0744 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6217 -3.5639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1808 -5.2596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7713 -5.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7865 -5.5529 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5936 -5.3821 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6996 -6.3734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0055 -6.0969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4531 -6.7096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5189 -4.3118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2333 -3.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9478 -4.3118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9478 -5.1368 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6785 -5.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8259 -6.1837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6241 -7.5166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9848 -6.7853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2290 -6.0092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1886 -6.0846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2659 -4.9484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 -2.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5188 -2.6618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0899 -1.8370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 1 2 0 0 0 0 4 2 2 0 0 0 0 5 3 1 0 0 0 0 6 4 1 0 0 0 0 6 5 2 0 0 0 0 7 1 1 0 0 0 0 2 1 1 0 0 0 0 8 7 2 0 0 0 0 9 2 1 0 0 0 0 9 8 1 0 0 0 0 7 10 1 0 0 0 0 12 11 1 0 0 0 0 13 11 1 0 0 0 0 15 13 1 0 0 0 0 15 14 1 0 0 0 0 11 10 1 1 0 0 0 15 16 2 0 0 0 0 17 12 1 0 0 0 0 14 12 1 0 0 0 0 19 14 1 0 0 0 0 20 19 1 0 0 0 0 12 21 1 1 0 0 0 14 22 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 24 1 0 0 0 0 26 24 1 0 0 0 0 27 25 1 0 0 0 0 28 26 1 0 0 0 0 19 29 1 6 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 25 32 1 0 0 0 0 32 33 1 6 0 0 0 27 34 1 0 0 0 0 28 35 1 0 0 0 0 26 36 2 0 0 0 0 25 37 1 6 0 0 0 20 18 1 0 0 0 0 22 38 2 0 0 0 0 24 39 1 1 0 0 0 17 40 1 6 0 0 0 20 41 1 1 0 0 0 28 27 2 0 0 0 0 17 18 1 0 0 0 0 18 42 2 0 0 0 0 M END > CHEBI:68814 > cytoglobosin A > A cytochalasan alkaloid found in Chaetomium globosum. > 3 > (3S,3aR,4S,6S,6aR,7E,10S,10aR,13aR,15aR)-6,12-dihydroxy-3-(1H-indol-3-ylmethyl)-4,10,11-trimethyl-5-methylidene-2,3,3a,4,5,6,6a,9,10,10a,13a,14-dodecahydro-1H-cyclopenta[7,8]cyclodeca[1,2-d]isoindole-1,13,15-trione > C32H36N2O5 > 528.63860 > 528.26242 > 0 > C[C@H]1[C@H]2[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@@]22[C@@H](\C=C\C[C@H](C)[C@@H]3[C@@H](CC2=O)C(=O)C(O)=C3C)[C@H](O)C1=C > InChI=1S/C32H36N2O5/c1-15-8-7-10-22-28(36)17(3)16(2)27-24(12-19-14-33-23-11-6-5-9-20(19)23)34-31(39)32(22,27)25(35)13-21-26(15)18(4)29(37)30(21)38/h5-7,9-11,14-16,21-22,24,26-28,33,36-37H,3,8,12-13H2,1-2,4H3,(H,34,39)/b10-7+/t15-,16+,21+,22-,24-,26-,27-,28+,32+/m0/s1 > VROGJHMZKMLYET-NKUOSLKNSA-N > 20548377 > 20225834 $$$$