input word = C00040299

Metabolite InformationStructural formula
Name Shizukaol K
Formula C38H44O11
Mw 676.28836225
CAS RN 1006590-89-1
C_ID C00040299 ,
InChIKey FXXDZYIYSHRRHM-BQLOOFNVNA-N
InChICode InChI=1S/C38H44O11/c1-15(2)8-27(40)48-14-37(45)24-11-23(24)35(5)25(37)12-22-20(13-47-17(4)39)34(44)49-38(22)26(35)10-19-18-9-21(18)36(6)29(19)30(38)28(31(41)32(36)42)16(3)33(43)46-7/h8,18,21,23-26,30,32,42,45H,9-14H2,1-7H3/b28-16-/t18-,21-,23-,24+,25-,26+,30+,32+,35+,36+,37+,38+/m1/s1
SMILES [C@@]12([C@@H](CC3=C(C(=O)O[C@@]43[C@H]1CC1=C3[C@@H]4/C(=C(\C)/C(=O)OC)/C(=O)[C@@H]([C@]3([C@H]3[C@@H]1C3)C)O)COC(=O)C)[C@@]([C@@H]1[C@H]2C1)(COC(=O)C=C(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChloranthaceaeChloranthus fortunei Ref.
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