input word = C00015449

Metabolite InformationStructural formula
Name L 681512-4
Formula C48H82O12S
Mw 882.55269881
CAS RN 126348-76-3
C_ID C00015449 ,
InChIKey NUOVIAPJOSFRAJ-ABFWCYKCNA-N
InChICode InChI=1S/C48H82O12S/c1-32(27-28-48(31-57-48)45(5,6)53)35-24-25-36-34-23-26-38-44(3,4)42(60-61(54,55)56)37(30-46(38,7)40(34)41(52)43(47(35,36)8)58-33(2)50)59-39(51)22-20-18-16-14-12-10-9-11-13-15-17-19-21-29-49/h32,35-38,41-43,49,52-53H,9-31H2,1-8H3,(H,54,55,56)/t32-,35-,36+,37-,38+,41-,42+,43+,46+,47-,48-/m1/s1
SMILES [C@@H]1([C@@H](C([C@H]2[C@](C1)(C1=C(CC2)[C@H]2[C@]([C@H]([C@@H]1O)OC(=O)C)([C@H](CC2)[C@@H](CC[C@@]1(CO1)C(O)(C)C)C)C)C)(C)C)OS(=O)(=O)O)OC(=O)CCCCCCCCCCCCCCCO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiNectriaceaeFusarium sp. FO-6651 Ref.
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