| Name |
Chloropolysporin B |
| Formula |
C83H89Cl3N8O34 |
| Mw |
1846.45467519 |
| CAS RN |
105650-11-1 |
| C_ID |
C00017873
, 
|
| InChIKey |
PCGBWZQZOMMXGB-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C83H89Cl3N8O34/c1-27-61(101)42(87)24-52(119-27)126-71-32-8-14-46(40(85)18-32)122-48-20-34-21-49(73(48)128-83-70(110)67(107)64(104)51(26-96)125-83)123-47-15-9-33(19-41(47)86)72(127-82-69(109)66(106)63(103)50(25-95)124-82)60(93-74(111)54(88-3)29-4-10-36(11-5-29)121-81-68(108)65(105)62(102)28(2)120-81)78(115)90-56(31-7-13-44(99)39(84)17-31)75(112)91-57(34)77(114)89-55-30-6-12-43(98)37(16-30)53-38(22-35(97)23-45(53)100)58(80(117)118)92-79(116)59(71)94-76(55)113/h4-23,27-28,42,50-52,54-72,81-83,88,95-110H,24-26,87H2,1-3H3,(H,89,114)(H,90,115)(H,91,112)(H,92,116)(H,93,111)(H,94,113)(H,117,118)/t27-,28+,42-,50-,51-,52+,54+,55+,56+,57-,58-,59+,60-,61+,62-,63-,64+,65+,66-,67+,68-,69+,70-,71+,72-,81+,82-,83+/m1/s1 |
| SMILES |
c1(cc2ccc1Oc1cc3cc(c1O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)Oc1ccc(cc1Cl)[C@H]([C@H](C(=O)N[C@@H](c1cc(c(cc1)O)Cl)C(=O)N[C@H]3C(=O)N[C@@H]1C(=O)N[C@@H]([C@H]2O[C@@H]2O[C@@H]([C@@H]([C@@H](C2)N)O)C)C(=O)N[C@H](c2c(c3cc1ccc3O)c(cc(c2)O)O)C(=O)O)NC(=O)[C@@H](NC)c1ccc(cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)C)O)O)O)O[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)Cl |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| -- | Pseudonocardiaceae | Faenia interjecta SANK 60983 | Ref. |
|
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