input word = C00026836

Metabolite InformationStructural formula
Name Leptosin M1
Formula C33H36N6O8S2
Mw 708.20360363
CAS RN 406213-88-5
C_ID C00026836 ,
InChIKey ZVARQDQPESZGQS-QAFMCYJSNA-N
InChICode InChI=1S/C33H36N6O8S2/c1-15(2)32-28(46)39-25-30(17-11-7-9-13-19(17)35-25,23(43)33(39,49-48-32)27(45)37(32)4)29-16-10-6-8-12-18(16)34-24(29)38-21(41)20(14-40)36(3)26(44)31(38,47-5)22(29)42/h6-13,15,20,22-25,34-35,40,42-43H,14H2,1-5H3/t20-,22-,23-,24-,25+,29?,30+,31-,32-,33-/m0/s1
SMILES CO[C@@]12C(=O)N(C)[C@@H](CO)C(=O)N1[C@@H]1Nc3ccccc3[C@]1([C@@]13c4ccccc4N[C@@H]1N1C(=O)[C@]4(C(C)C)SS[C@]1(C(=O)N4C)[C@H]3O)[C@@H]2O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
--Leptoshaeria sp.OUPS-4 Ref.
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OrganismLeptoshaeria sp.OUPS-4
ReferenceYamada,Tetrahedron,58,(2002),479