input word = C00060701

Metabolite InformationStructural formula
Name Tremulone
Formula C29H46O
Mw 410.35486609
CAS RN 2034-72-2
C_ID C00060701
InChIKey LCFUUGFUQQAYMY-CJAQKTMASA-N
InChICode InChI=1S/C29H46O/c1-7-21(19(2)3)12-11-20(4)23-13-14-24-27-25(15-17-29(23,24)6)28(5)16-9-8-10-22(28)18-26(27)30/h8,10,18-21,23-25,27H,7,9,11-17H2,1-6H3/t20-,21-,23-,24+,25+,27+,28+,29-/m1/s1
SMILES CCC(CCC(C)C1CCC2C3C(=O)C=C4C=CCCC4(C)C3CCC12C)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeCapsella bursa-pastoris Ref.
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