input word = C00048541

Metabolite InformationStructural formula
Name Sinuolatin D
(-)-Sinuolatin D
Formula C24H32O7
Mw 432.21480338
CAS RN 1196974-04-5
C_ID C00048541 ,
InChIKey NGGQOCWAVGUKFE-ZHTDEOGXNA-N
InChICode InChI=1S/C24H32O7/c1-11-14-9-23(19(11)29-12(2)25)17(16-15(14)31-16)22-8-6-7-21(4,5)18(22)20(30-13(3)26)24(23,27)28-10-22/h14-20,27H,1,6-10H2,2-5H3/t14-,15-,16-,17+,18-,19-,20+,22-,23+,24-/m1/s1
SMILES C1[C@]23[C@@H]4[C@H]5[C@@H]([C@@H]6C[C@@]4([C@]([C@H]([C@@H]2C(CCC3)(C)C)OC(=O)C)(O)O1)[C@@H](C6=C)OC(=O)C)O5
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon sinuolata Ref.
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