input word = C00023521

Metabolite InformationStructural formula
Name Clerodinin D
Formula C26H40O8
Mw 480.27231825
CAS RN 124815-92-5
C_ID C00023521 ,
InChIKey NNGXCYCJTUSCQE-CJCSFZFSNA-N
InChICode InChI=1S/C26H40O8/c1-6-29-22-12-18-11-20(33-23(18)34-22)24(5)15(2)10-21(32-17(4)28)26(14-30-16(3)27)19(24)8-7-9-25(26)13-31-25/h15,18-23H,6-14H2,1-5H3/t15-,18+,19-,20+,21+,22+,23-,24+,25+,26+/m1/s1
SMILES CCO[C@@H]1C[C@@H]2C[C@@H]([C@@]3(C)[C@H](C)C[C@H](OC(C)=O)[C@]4(COC(C)=O)[C@@H]3CCC[C@]43CO3)O[C@@H]2O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVerbenaceaeClerodendron brachyanthum Ref.
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