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CHEBI:220296 - 28-deoxystambomycin C
| Formula | C72H131NO21 |
| Net Charge | 0 |
| Average Mass | 1346.826 |
| Monoisotopic Mass | 1345.92136 |
| SMILES | C/C1=C/C(CCCC(C)C)C(O)CCCC(O)CC(O)CC(O)C(C)CCC(O)C(C)C(O)CCCC(O)CC(O)/C=C\C(C)OC(=O)CC2(O)OC(CC(O[C@@H]3O[C@H](C)[C@@H](O)[C@H](N(C)C)[C@H]3O)C2C)C(C)C(O)/C(C)=C\C=C/CC(O)C(C)C(O)CCCC(O)CC1O |
| InChI | InChI=1S/C72H131NO21/c1-41(2)20-16-22-51-34-44(5)63(85)37-54(76)25-18-28-58(80)46(7)57(79)26-15-14-21-43(4)68(87)48(9)64-39-65(93-71-70(89)67(73(12)13)69(88)50(11)92-71)49(10)72(90,94-64)40-66(86)91-45(6)31-32-55(77)35-52(74)23-17-27-59(81)47(8)60(82)33-30-42(3)62(84)38-56(78)36-53(75)24-19-29-61(51)83/h14-15,21,31-32,34,41-42,45-65,67-71,74-85,87-90H,16-20,22-30,33,35-40H2,1-13H3/b15-14-,32-31-,43-21-,44-34-/t42?,45?,46?,47?,48?,49?,50-,51?,52?,53?,54?,55?,56?,57?,58?,59?,60?,61?,62?,63?,64?,65?,67+,68?,69-,70-,71+,72?/m1/s1 |
| InChIKey | ZUKYKBUZWIWCFL-QSFOOMCYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (24220109) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 28-deoxystambomycin C (CHEBI:220296) is a aminoglycoside (CHEBI:47779) |
| IUPAC Name |
|---|
| (6E,30E,42E,44E)-50-[(2R,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-1,8,10,14,16,20,22,24,28,32,34,38,40,46-tetradecahydroxy-5,15,19,31,39,45,47,51-octamethyl-29-(4-methylpentyl)-4,52-dioxabicyclo[46.3.1]dopentaconta-6,30,42,44-tetraen-3-one |