input word = C00054287

Metabolite InformationStructural formula
Name Aeglin
Formula C25H34O11
Mw 510.21011193
CAS RN 169626-23-7
C_ID C00054287
InChIKey HLXHWKRKFDBAEQ-MDWZMJQESA-N
InChICode InChI=1S/C25H34O11/c1-13(8-9-33-15-6-4-14-5-7-20(28)34-17(14)10-15)16(27)11-19(25(2,3)32)36-24-23(31)22(30)21(29)18(12-26)35-24/h4-8,10,16,18-19,21-24,26-27,29-32H,9,11-12H2,1-3H3/b13-8+
SMILES O=C(C=C1)OC2=C1C=CC(OC/C=C(C)/C(O)CC(C(C)(O)C)OC3C(O)C(O)C(O)C(CO)O3)=C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeAegle marmelos Ref.
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