| Name |
Hibarimicin I |
| Formula |
C77H100O35 |
| Mw |
1584.60451497 |
| CAS RN |
446874-62-0 |
| C_ID |
C00015223
, 
|
| InChIKey |
DWVTVJUNKUSADX-FWQFRDQNNA-N |
| InChICode |
InChI=1S/C77H100O35/c1-12-18-73(95)71(110-39-16-14-34(79)25(3)102-39)61(91)64(108-41-22-35(80)53(83)27(5)104-41)33-21-31-20-32-45(55(85)44(31)69(93)76(33,73)97)56(86)49(67(101-11)63(32)99-9)48-57(87)46-47(60(90)66(48)100-10)58(88)50-51(59(46)89)70(94)77(98)52-65(50)112-74(77,19-13-2)72(62(92)68(52)109-42-23-36(81)54(84)28(6)105-42)111-40-17-15-37(26(4)103-40)107-43-24-38(82)75(96,29(7)78)30(8)106-43/h20,25-28,30,33-43,52-54,61-62,64-65,68,71-72,79-86,88-89,91-92,95-98H,12-19,21-24H2,1-11H3/t25-,26+,27+,28-,30-,33-,34+,35+,36-,37+,38+,39+,40+,41-,42+,43-,52+,53-,54-,61+,62-,64-,65-,68+,71-,72+,73-,74-,75+,76+,77?/m1/s1 |
| SMILES |
CCCC1(O)C(O[C@H]2CC[C@H](O)C(C)O2)C(O)C(OC2C[C@@H](O)[C@H](O)C(C)O2)C2Cc3cc4c(OC)c(OC)c(C5=C(OC)C(=O)c6c(O)c7c(c(O)c6C5=O)C(=O)C5(O)C6C7OC5(CCC)C(O[C@H]5CC[C@H](OC7CC(O)C(O)(C(C)=O)C(C)O7)C(C)O5)C(O)C6O[C@H]5C[C@@H](O)[C@@H](O)C(C)O5)c(O)c4c(O)c3C(=O)C21O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Bacteria | Micromonosporaceae | Microbispora rosea subsp. hibaria | Ref. |
|
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