input word = C00032523

Metabolite InformationStructural formula
Name Xindongnin H
(-)-Xindongnin H
Formula C22H30O6
Mw 390.20423869
CAS RN 769923-93-5
C_ID C00032523 ,
InChIKey YTAFABTWZSCKAH-ARDPSSSUNA-N
InChICode InChI=1S/C22H30O6/c1-10-12-8-22(19(10)27)9-13(24)17-20(3,4)14(28-11(2)23)6-7-21(17,5)18(22)16(26)15(12)25/h12,14-18,25-26H,1,6-9H2,2-5H3/t12-,14+,15-,16+,17-,18+,21-,22+/m1/s1
SMILES C1[C@@H](C([C@@H]2[C@@](C1)([C@H]1[C@@]3(CC2=O)C[C@@H]([C@H]([C@@H]1O)O)C(=C)C3=O)C)(C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon rubescens var. rubescens Ref.
PlantaeLamiaceaeRabdosia rubescens Ref.
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OrganismRabdosia rubescens
ReferenceHAN, et al., Chem Pharm Bull, 52, (2004), 767