| Name |
TMC 2A
L-Tryptophyl-(3S)-1,2,3,4-tetrahydro-6,8-dihydroxy-7-methoxy-3-isoquinolinecarbonyl-5,5'-dihydroxy-L-leucine |
| Formula |
C28H34N4O9 |
| Mw |
570.23257871 |
| CAS RN |
195976-77-3 |
| C_ID |
C00016353
, 
|
| InChIKey |
ODKDMMTXTVCCLJ-RXEWNDAWNA-N |
| InChICode |
InChI=1S/C28H34N4O9/c1-41-25-23(35)9-15-8-22(26(37)31-21(28(39)40)6-14(12-33)13-34)32(11-18(15)24(25)36)27(38)19(29)7-16-10-30-20-5-3-2-4-17(16)20/h2-5,9-10,14,19,21-22,30,33-36H,6-8,11-13,29H2,1H3,(H,31,37)(H,39,40)/t19-,21+,22+/m1/s1 |
| SMILES |
c12c(cc(c(c1O)OC)O)C[C@H](N(C2)C(=O)[C@H](N)Cc1c2c([nH]c1)cccc2)C(=O)N[C@@H](CC(CO)CO)C(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Fungi | Trichocomaceae | Aspergillus oryzae A437 | Ref. |
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