| Name |
Angelmicin B
Hibarimicin B |
| Formula |
C85H112O37 |
| Mw |
1724.6882446 |
| CAS RN |
151687-86-4 |
| C_ID |
C00016038
, 
|
| InChIKey |
XGHSXRXEPCUHTN-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C85H112O37/c1-14-22-82(104)78(120-45-18-16-43(30(3)110-45)116-47-20-24-80(102,34(7)86)36(9)114-47)68(98)71(118-49-28-41(88)60(90)32(5)112-49)40-27-38-26-39-52(62(92)51(38)76(100)84(40,82)105)63(93)56(74(109-13)70(39)107-11)55-64(94)53-54(67(97)73(55)108-12)65(95)57-58(66(53)96)77(101)85(106)59-72(57)122-83(85,23-15-2)79(69(99)75(59)119-50-29-42(89)61(91)33(6)113-50)121-46-19-17-44(31(4)111-46)117-48-21-25-81(103,35(8)87)37(10)115-48/h26,30-33,36-37,40-50,59-61,68-69,71-72,75,78-79,88-93,95-96,98-99,102-106H,14-25,27-29H2,1-13H3/t30-,31+,32+,33+,36-,37+,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 |
C1[C@@]([C@H](O[C@@H](C1)O[C@@H]1CC[C@@H](O[C@@H]1C)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]3O[C@H]([C@H]([C@@H](C3)O)O)C)O)O[C@@H]3O[C@H]([C@@H](CC3)O[C@@H]3O[C@H]([C@@](CC3)(O)C(=O)C)C)C)(O2)CCC)O)O)C1=O)OC)O)O)O[C@H]1O[C@H]([C@H]([C@@H](C1)O)O)C)C)(C(=O)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Bacteria | Micromonosporaceae | Microbispora rosea subsp. hibaria TP-A0121 | Ref. |
| Bacteria | Micromonosporaceae | Microbispora sp. AA9966 | Ref. |
|
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