input word = C00047367

Metabolite InformationStructural formula
Name 7-O-Acetylpseurata C
(+)-7-O-Acetylpseurata C
Formula C24H32O7
Mw 432.21480338
CAS RN 1151580-38-9
C_ID C00047367 ,
InChIKey ZJTQVLHYMFFVCC-VCIFWQFSNA-N
InChICode InChI=1S/C24H32O7/c1-11-19-14(27)9-16-23(6)8-7-17(30-12(2)25)22(4,5)15(23)10-18(31-13(3)26)24(16,20(11)28)21(19)29/h15-19,21,29H,1,7-10H2,2-6H3/t15-,16+,17+,18-,19-,21-,23-,24+/m1/s1
SMILES [C@@H]1([C@@]23[C@@H](CC(=O)[C@H]1C(=C)C3=O)[C@]1([C@H](C[C@H]2OC(=O)C)C([C@H](CC1)OC(=O)C)(C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon pharicus Ref.
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