| 2D Structure | |
| CID | 72320 |
| IUPAC Name | [(1R,2R,4S,7S,8S,11R,12R,13S,18R)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosan-13-yl] acetate |
| InChI | InChI=1S/C28H34O9/c1-14(29)34-19-12-20(31)36-24(2,3)17-11-18(30)27(6)16(26(17,19)5)7-9-25(4)21(15-8-10-33-13-15)35-23(32)22-28(25,27)37-22/h8,10,13,16-17,19,21-22H,7,9,11-12H2,1-6H3/t16-,17+,19+,21+,22-,25+,26-,27+,28-/m1/s1 |
| InChI Key | KPDOJFFZKAUIOE-WNGDLQANSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C28H34O9 |
| Molecular Weight | 514.6 |
| synonyms | ['Nomilin', '1063-77-0', 'DRM0753K4T', 'NSC-297134', '(7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo(9.9.0.02,4.02,8.012,18)icosan-13-yl) acetate', "methyl (1S,4aS,7R,7aS)-4'-((1S)-1-hydroxyethyl)-5'-oxo-1-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl)oxy-spiro(4a,7a-dihydro-1H-cyclopenta(c)pyran-7,2'-furan)-4-carboxylate", '1-(acetyloxy)-1,2-dihydroobacunoic acid e-lactone', "(1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-1-(Furan-3-yl)-4b,7,7,11a,13a-pentamethyl-3,5,9-trioxohexadecahydrooxepino[4',3':3,4]benzo[1,2-f]oxireno[2,3-d]isochromen-11-yl acetate", 'Nomilin (~85%)', 'AC1L2HUM', '1-(Acetyloxy)-1,2-dihydroobacunoic acid eta-lactone', 'AC1Q6OA3', 'UNII-DRM0753K4T', 'MFCD00075979', 'KST-1A9791', 'Nomilin (Standard)', 'NSC 297134', 'AI3-37935', 'NOMILIN [MI]', '1-(Acetyloxy)-1,2-dihydroobacunoic acid .epislon.-lactone', 'Obacunoic acid, 1-(acetyloxy)-1,2-dihydro-, eta-lactone', 'SCHEMBL691775', 'CHEBI:7609', 'CHEMBL4740267', 'HY-N0547R', 'KPDOJFFZKAUIOE-WNGDLQANSA-N', 'GLXC-10128', 'HY-N0547', 'AKOS037514753', 'AC-34406', '(3-furyl-pentamethyl-trioxo-[?]yl) acetate', 'CS-0009075', 'C08773', 'SR-05000002184', 'Q1191572', 'SR-05000002184-2', '1-(ACETYLOXY)-1,2-DIHYDROOBACUNOIC ACID .EPSILON.-LACTONE', '(1R,2R,4S,7R,8S,11R,12R,13S,18R)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.0?,?.0?,?.0??,??]icosan-13-yl acetate', '(1S,3AS,4AR,4BR,6AR,11S,11AR,11BR,13AS)-11-(ACETYLOXY)-1-(3-FURANYL)DECAHYDRO-4B,7,7,11A,13A-PENTAMETHYLOXIRENO(4,4A)-2-BENZOPYRAN(6,5-G)(2)BENZOXEPIN-3,5,9(3AH,4BH,6H)-TRIONE', '[(1R,2R,4S,7S,8S,11R,12R,13S,18R)-7-(3-furyl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosan-13-yl] acetate', '[(1R,2R,4S,7S,8S,11R,12R,13S,18R)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosan-13-yl] acetate', 'G3L'] |
From Pubchem