input word = C00064337

Metabolite InformationStructural formula
Name Quinovic acid
Formula C30H46O5
Mw 486.33452458
CAS RN 465-74-7
C_ID C00064337
InChIKey OJUYFGQEMPENCE-DPKHZRJYSA-N
InChICode InChI=1S/C30H46O5/c1-17-9-14-29(24(32)33)15-16-30(25(34)35)19(23(29)18(17)2)7-8-21-27(5)12-11-22(31)26(3,4)20(27)10-13-28(21,30)6/h7,17-18,20-23,31H,8-16H2,1-6H3,(H,32,33)(H,34,35)/t17-,18+,20+,21-,22+,23+,27+,28-,29+,30-/m1/s1
SMILES CC1CCC2(C(=O)O)CCC3(C(=O)O)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeMitragyna inermis Ref.
PlantaeRubiaceaeMitragyna stipulosa Ref.
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