input word = C00034486

Metabolite InformationStructural formula
Name Dolabellin
Formula C24H32Cl2N2O8S2
Mw 610.09771289
CAS RN 165467-49-2
C_ID C00034486 ,
InChIKey JHKFWJUVTLNOJZ-JAPGCXTFNA-N
InChICode InChI=1S/C24H32Cl2N2O8S2/c1-12(2)18(20-28-14(10-38-20)22(32)34-5)36-21(31)13(3)17(7-6-8-24(4,25)26)35-23(33)15-11-37-19(27-15)16(30)9-29/h10-13,16-18,29-30H,6-9H2,1-5H3/t13-,16-,17+,18+/m1/s1
SMILES [C@H]([C@H](C(=O)O[C@H](c1nc(cs1)C(=O)OC)C(C)C)C)(OC(=O)c1csc(n1)[C@@H](CO)O)CCCC(C)(Cl)Cl
Start Substs in Alk. Biosynthesis (Prediction) L-Pro
Organism
Kingdom Family Species Reference
--Lyngbya majuscula Ref.
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OrganismLyngbya majuscula
ReferenceTan,Phytochem.,68,(2007),954