input word = C00048515

Metabolite InformationStructural formula
Name Pulcherrimin C
Formula C34H36O8
Mw 572.24101813
CAS RN 186890-48-2
C_ID C00048515 ,
InChIKey NBIZLELOKAWPIH-HFGZQEDANA-N
InChICode InChI=1S/C34H36O8/c1-20-23-15-18-40-25(23)19-24-26(20)27(41-29(35)21-11-6-4-7-12-21)28(42-30(36)22-13-8-5-9-14-22)34(39)32(24,2)16-10-17-33(34,3)31(37)38/h4-9,11-15,18,20,24,26-28,39H,10,16-17,19H2,1-3H3,(H,37,38)/t20-,24-,26-,27+,28+,32+,33+,34-/m0/s1
SMILES C[C@H]1c2ccoc2C[C@H]2[C@H]1[C@@H](OC(=O)c1ccccc1)[C@@H](OC(=O)c1ccccc1)[C@@]1(O)[C@@](C)(C(=O)O)CCC[C@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCaesalpinia pulcherrima Ref.
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