input word = C00044117

Metabolite InformationStructural formula
Name Bullatin
Formula C37H66O7
Mw 622.48085446
CAS RN 158515-36-7
C_ID C00044117 ,
InChIKey ZKPIIYAYSXXUDC-SRNBYVNSNA-N
InChICode InChI=1S/C37H66O7/c1-3-4-5-6-7-8-12-15-21-31(39)33-23-25-35(43-33)36-26-24-34(44-36)32(40)22-17-16-20-30(38)19-14-11-9-10-13-18-29-27-28(2)42-37(29)41/h27-28,30-36,38-40H,3-26H2,1-2H3/t28-,30-,31+,32-,33-,34+,35-,36-/m1/s1
SMILES C(CCCCCC[C@@H]([C@H]1CC[C@@H](O1)[C@H]1CC[C@H](O1)[C@@H](CCCC[C@@H](CCCCCCCC1=C[C@H](OC1=O)C)O)O)O)CCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAsimina triloba Ref.
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