input word = C00034121

Metabolite InformationStructural formula
Name Phanginin A
(-)-Phanginin A
Formula C21H28O5
Mw 360.193674
CAS RN 1011528-58-7
C_ID C00034121 ,
InChIKey FBOCRPKLWNKMFW-LMHIIILXNA-N
InChICode InChI=1S/C21H28O5/c1-12-13-4-5-17-20(18(22)24-2)7-3-8-21(17,19(23)26-11-20)15(13)10-16-14(12)6-9-25-16/h6,9,12-13,15,17,19,23H,3-5,7-8,10-11H2,1-2H3/t12-,13+,15+,17+,19-,20+,21+/m1/s1
SMILES COC(=O)[C@@]12CCC[C@]3([C@H](O)OC1)[C@H]1Cc4occc4[C@H](C)[C@@H]1CC[C@@H]23
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCaesalpinia sappan Linn. Ref.
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