input word = C00037895

Metabolite InformationStructural formula
Name Teasterone-3-laurate
Formula C40H70O5
Mw 630.52232534
CAS RN 155063-64-2
C_ID C00037895 ,
InChIKey CJCFFXZLPKANKK-IDLNHXGWNA-N
InChICode InChI=1S/C40H70O5/c1-8-9-10-11-12-13-14-15-16-17-36(42)45-29-20-22-40(7)33-21-23-39(6)31(28(5)38(44)37(43)27(4)26(2)3)18-19-32(39)30(33)25-35(41)34(40)24-29/h26-34,37-38,43-44H,8-25H2,1-7H3/t27-,28-,29-,30-,31+,32-,33-,34+,37+,38+,39-,40+/m0/s1
SMILES C1[C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@H](CC2=O)[C@H]2[C@@](CC1)([C@H](CC2)[C@@H]([C@@H](O)[C@@H]([C@@H](C)C(C)C)O)C)C)C)OC(=O)CCCCCCCCCCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLiliaceaeLilium longiflorum Thunb. Ref.
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