input word = C00040287

Metabolite InformationStructural formula
Name Shearinine D
(+)-Shearinine D
Formula C37H45NO6
Mw 599.32468818
CAS RN 925427-34-5
C_ID C00040287 ,
InChIKey DFVYLDHDFLHIAA-HWQZAYHMNA-N
InChICode InChI=1S/C37H45NO6/c1-31(2)17-23-19-15-24-20(14-21(19)28(40)27(23)32(3,4)43-31)22-13-18-9-10-36(41)26-16-25(39)30-33(5,6)44-37(26,42-30)12-11-34(36,7)35(18,8)29(22)38-24/h14-18,27-28,30,38,40-41H,9-13H2,1-8H3/t18-,27+,28+,30-,34+,35+,36+,37-/m0/s1
SMILES c12c(cc3c(c1)[nH]c1c3C[C@H]3[C@]1([C@@]1([C@@](CC3)(C3=CC(=O)[C@H]4C(O[C@]3(CC1)O4)(C)C)O)C)C)[C@H]([C@H]1C2=CC(OC1(C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction) Indole-3 GGPP
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium janthinellum Biourge Ref.
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