input word = C00062682

Metabolite InformationStructural formula
Name Terrestrinin A
Formula C33H48O9
Mw 588.32983313
CAS RN 681277-16-7
C_ID C00062682
InChIKey VMTHRKNVFMFGID-SXAFTVORSA-N
InChICode InChI=1S/C33H48O9/c1-16(15-40-31-30(39)29(38)28(37)25(14-34)42-31)5-8-23-17(2)27-24(41-23)12-22-20-7-6-18-11-19(35)9-10-32(18,3)21(20)13-26(36)33(22,27)4/h11,16,20-22,24-25,27-31,34,37-39H,5-10,12-15H2,1-4H3/t16-,20+,21-,22-,24-,25+,27-,28+,29-,30+,31+,32-,33+/m0/s1
SMILES CC1=C(CCC(C)COC2OC(CO)C(O)C(O)C2O)OC2CC3C4CCC5=CC(=O)CCC5(C)C4CC(=O)C3(C)C12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZygophyllaceaeTribulus terrestris Ref.
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