input word = C00047426

Metabolite InformationStructural formula
Name Coronalolide
Formula C30H42O5
Mw 482.30322445
CAS RN 268214-51-3
C_ID C00047426 ,
InChIKey YLQIANWVVVMWMO-SSDWHHQGNA-N
InChICode InChI=1S/C30H42O5/c1-18(16-31)7-6-8-19(2)21-9-11-28(5)23-15-22-25(20(3)26(34)35-22)30(12-10-24(32)33)17-29(23,30)14-13-27(21,28)4/h7,16,19,21-23,25H,3,6,8-15,17H2,1-2,4-5H3,(H,32,33)/b18-7+/t19-,21-,22-,23+,25-,27-,28+,29+,30-/m1/s1
SMILES C=C1C(=O)O[C@@H]2C[C@@H]3[C@]4(CC[C@]5(C)[C@@H]([C@H](C)CC/C=C(C)C=O)CC[C@@]35C)C[C@]4(CCC(=O)O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeGardenia sootepensis Ref.
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