input word = C00015655

Metabolite InformationStructural formula
Name Tubulysin D
(+)-Tubulysin D
Formula C43H65N5O9S
Mw 827.45029944
CAS RN 309935-57-7
C_ID C00015655 ,
InChIKey SAJNCFZAPSBQTQ-ZNKBOWJJNA-N
InChICode InChI=1S/C43H65N5O9S/c1-10-28(6)38(46-40(52)34-18-14-15-19-47(34)9)42(53)48(25-56-37(50)20-26(2)3)35(27(4)5)23-36(57-30(8)49)41-45-33(24-58-41)39(51)44-32(21-29(7)43(54)55)22-31-16-12-11-13-17-31/h11-13,16-17,24,26-29,32,34-36,38H,10,14-15,18-23,25H2,1-9H3,(H,44,51)(H,46,52)(H,54,55)/t28-,29-,32+,34+,35+,36+,38-/m0/s1
SMILES [C@@H](C[C@@H](NC(=O)c1csc(n1)[C@H](OC(=O)C)C[C@H](C(C)C)N(COC(=O)CC(C)C)C(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]1CCCCN1C)Cc1ccccc1)(C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys
Organism
Kingdom Family Species Reference
BacteriaCystobacteraceaeAngiococcus disciformis An d48 Ref.
PlantaeMenispermaceaeArchangium gephyra Ref.
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