input word = C00024147

Metabolite InformationStructural formula
Name Calyxin E
Formula C35H34O8
Mw 582.22536806
CAS RN 205313-08-2
C_ID C00024147 ,
InChIKey LQWWCAPEPBPSDD-RWELNHBXNA-N
InChICode InChI=1S/C35H34O8/c1-42-32-20-29(40)33(35-34(32)30(41)19-31(43-35)23-9-16-27(38)17-10-23)24(8-2-21-3-11-25(36)12-4-21)18-28(39)15-7-22-5-13-26(37)14-6-22/h2-6,8-14,16-17,20,24,28,31,36-40H,7,15,18-19H2,1H3/b8-2+/t24-,28-,31-/m0/s1
SMILES c1(cc(c2c(c1[C@@H](/C=C/c1ccc(cc1)O)C[C@H](CCc1ccc(cc1)O)O)O[C@@H](CC2=O)c1ccc(cc1)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZingiberaceaeAlpinia blepharocalyx K.SCHUM. Ref.
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