input word = C00042551

Metabolite InformationStructural formula
Name Gelomulide H
(-)-Gelomulide H
Formula C22H28O6
Mw 388.18858863
CAS RN 219915-74-9
C_ID C00042551 ,
InChIKey YGMPFLMYCKNEEV-PXLHWVRBNA-N
InChICode InChI=1S/C22H28O6/c1-11-17-13(28-19(11)25)10-15-21(5)8-7-16(24)20(3,4)14(21)6-9-22(15,26)18(17)27-12(2)23/h7-8,13-15,18,26H,6,9-10H2,1-5H3/t13-,14-,15+,18+,21-,22+/m1/s1
SMILES C1=C[C@@]2([C@@H](C(C1=O)(C)C)CC[C@@]1([C@H]2C[C@@H]2C(=C(C(=O)O2)C)[C@@H]1OC(=O)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeGelonium multiflorum A. Ref.
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