input word =
C00051946
Metabolite Information
Structural formula
Name
Lolitrem J
Formula
C39H51NO8
Mw
661.36146761
CAS RN
C_ID
C00051946
InChIKey
InChICode
InChI=1S/C39H51NO8/c1-18(41)46-35(6,7)31-29(43)32-39(47-32)25(45-31)13-14-36(8)37(9)19(12-15-38(36,39)44)16-22-26-21-17-23-27(34(4,5)48-33(23,2)3)28(42)20(21)10-11-24(26)40-30(22)37/h10-11,19,23,25,27,29,31-32,40,43-44H,12-17H2,1-9H3/t19?,23-,25+,27+,29-,31+,32?,36-,37-,38+,39+/m1/s1
SMILES
[C@H]1([C@@H](C(OC(=O)C)(C)C)O[C@@H]2[C@]3(C1O3)[C@]1([C@](CC2)([C@@]2(C(CC1)Cc1c2[nH]c2c1c1c(cc2)C(=O)[C@@H]2[C@@H](C1)C(OC2(C)C)(C)C)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom
Family
Species
Reference
Fungi
Clavicipitaceae
Epichloe festucae Fg1
Ref.
Fungi
Clavicipitaceae
Epichloe festucae Fl1
Ref.
-
-
Neotyphodium lolii Lp19
Ref.
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