input word = C00047689

Metabolite InformationStructural formula
Name 7-Deacetylkhivorin
Formula C30H40O9
Mw 544.26723288
CAS RN 23577-64-2
C_ID C00047689 ,
InChIKey MRMHZWKIOFZZID-MEUNVVMINA-N
InChICode InChI=1S/C30H40O9/c1-15(31)36-21-13-22(37-16(2)32)28(6)18-8-10-27(5)23(17-9-11-35-14-17)38-25(34)24-30(27,39-24)29(18,7)20(33)12-19(28)26(21,3)4/h9,11,14,18-24,33H,8,10,12-13H2,1-7H3/t18-,19+,20-,21-,22+,23+,24-,27+,28-,29+,30-/m1/s1
SMILES CC(=O)O[C@H]1C[C@@H](OC(C)=O)C(C)(C)[C@@H]2C[C@@H](O)[C@]3(C)[C@H](CC[C@@]4(C)[C@H](c5ccoc5)OC(=O)[C@H]5O[C@@]534)[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeSwietenia mahagoni Ref.
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