input word = C00012371

Metabolite InformationStructural formula
Name Incaspitolide E
Formula C23H34O9
Mw 454.22028269
CAS RN 81915-77-7
C_ID C00012371 ,
InChIKey DXYDSSOEDQWWLR-UHFFFAOYNA-N
InChICode InChI=1S/C23H34O9/c1-10(2)19(24)30-17-15-13(6)21(26)29-16(15)18(31-20(25)11(3)4)22(7,27)14-9-8-12(5)23(17,28)32-14/h10-12,14-18,27-28H,6,8-9H2,1-5,7H3/t12-,14-,15-,16-,17+,18+,22-,23-/m1/s1
SMILES C=C1C(=O)OC2C1C(OC(=O)C(C)C)C1(O)OC(CCC1C)C(C)(O)C2OC(=O)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeInula cuspidata Ref.
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