input word = C00034580

Metabolite InformationStructural formula
Name Lyngbyabellin D
(+)-Lyngbyabellin D
Formula C38H55Cl2N3O13S2
Mw 895.25533575
CAS RN 532427-69-3
C_ID C00034580 ,
InChIKey VDFRHOQVEAPBIB-MKDFVMCKNA-N
InChICode InChI=1S/C38H55Cl2N3O13S2/c1-10-13-28(46)43-30(20(3)4)27(54-22(6)44)16-29(47)53-17-25(45)32-41-24(19-57-32)36(50)55-26(14-12-15-38(8,39)40)21(5)34(48)56-31(37(7,51)11-2)33-42-23(18-58-33)35(49)52-9/h18-21,25-27,30-31,45,51H,10-17H2,1-9H3,(H,43,46)/t21-,25-,26+,27-,30+,31+,37+/m1/s1
SMILES CCCC(=O)N[C@@H](C(C)C)[C@@H](CC(=O)OC[C@@H](O)c1nc(C(=O)O[C@@H](CCCC(C)(Cl)Cl)[C@@H](C)C(=O)O[C@@H](c2nc(C(=O)OC)cs2)[C@@](C)(O)CC)cs1)OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro
Organism
Kingdom Family Species Reference
--Lyngbya sp. Ref.
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