| Name |
Celogentin B
(-)-Celogentin B |
| Formula |
C51H70N16O10 |
| Mw |
1066.54608257 |
| CAS RN |
370089-21-7 |
| C_ID |
C00027057
, 
|
| InChIKey |
JXRNLQXLWVJGAA-FHYXOTNTNA-N |
| InChICode |
InChI=1S/C51H70N16O10/c1-7-25(6)40-48(74)64-39(24(4)5)47(73)62-35-18-30-29-11-10-26(38(23(2)3)41(49(75)65-40)66-44(70)32-12-13-37(68)58-32)15-33(29)59-42(30)67-20-28(57-22-67)17-34(45(71)63-36(50(76)77)16-27-19-54-21-56-27)61-43(69)31(60-46(35)72)9-8-14-55-51(52)53/h10-11,15,19-25,31-32,34-36,38-41,59H,7-9,12-14,16-18H2,1-6H3,(H,54,56)(H,58,68)(H,60,72)(H,61,69)(H,62,73)(H,63,71)(H,64,74)(H,65,75)(H,66,70)(H,76,77)(H4,52,53,55)/t25-,31+,32+,34+,35+,36+,38-,39+,40+,41+/m1/s1 |
| SMILES |
CCC(C)[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H]2CCC(=O)N2)[C@H](C(C)C)c2ccc3c4c([nH]c3c2)-n2cnc(c2)C[C@@H](C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C4)NC(=O)[C@H](C(C)C)NC1=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Amaranthaceae | Celosia argentea  | Ref. |
|
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