| Name |
Hibarimicin G |
| Formula |
C85H112O38 |
| Mw |
1740.68315922 |
| CAS RN |
208588-87-8 |
| C_ID |
C00016040
, 
|
| InChIKey |
NBQIPBWBWLRUKS-VKARVFTLNA-N |
| InChICode |
InChI=1S/C85H112O38/c1-14-21-81(104)78(121-45-18-16-42(29(3)111-45)117-47-20-23-80(103,33(7)86)35(9)115-47)68(99)71(119-48-26-40(88)60(91)31(5)113-48)39-25-37-24-38-52(62(93)51(37)76(101)84(39,81)106)63(94)56(74(110-13)70(38)108-11)55-64(95)53-54(67(98)73(55)109-12)65(96)57-58(66(53)97)77(102)85(107)59-72(57)123-82(85,22-15-2)79(69(100)75(59)120-49-27-41(89)61(92)32(6)114-49)122-46-19-17-43(30(4)112-46)118-50-28-44(90)83(105,34(8)87)36(10)116-50/h24,29-32,35-36,39-50,59-61,68-69,71-72,75,78-79,88-94,96-97,99-100,103-107H,14-23,25-28H2,1-13H3/t29-,30-,31+,32+,35+,36+,39+,40-,41+,42+,43+,44-,45+,46+,47+,48+,49?,50+,59-,60-,61-,68+,69+,71+,72+,75-,78-,79-,80-,81+,82+,83-,84-,85-/m1/s1 |
| SMILES |
O([C@@H]1[C@@H](O)[C@H]([C@H]2[C@]([C@@]1(CCC)O)(C(=O)c1c(C2)cc2c(c1O)c(c(c(c2OC)OC)C1=C(C(=O)c2c(c(c3c(c2O)[C@H]2[C@H]4[C@@](C3=O)([C@]([C@@H]([C@H]([C@@H]4O[C@@H]3C[C@@H]([C@@H]([C@@H](O3)C)O)O)O)O[C@H]3CC[C@@H]([C@H](O3)C)O[C@H]3C[C@H]([C@@]([C@@H](O3)C)(O)C(=O)C)O)(O2)CCC)O)O)C1=O)OC)O)O)O[C@H]1C[C@H]([C@@H]([C@@H](O1)C)O)O)[C@H]1CC[C@@H]([C@H](O1)C)O[C@H]1CC[C@@]([C@@H](O1)C)(O)C(=O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Bacteria | Micromonosporaceae | Microbispora rosea subsp. hibaria TP-A0121 | Ref. |
|
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