input word = C00001302

Metabolite InformationStructural formula
Name Bullatacinone
Formula C37H66O7
Mw 622.48085446
CAS RN 123012-00-0
C_ID C00001302 ,
InChIKey KGGVWMAPBXIMEM-YOIUDZBLNA-N
InChICode InChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30-27-29(26-28(2)38)37(41)42-30/h29-36,39-40H,3-27H2,1-2H3/t29-,30+,31+,32+,33-,34-,35-,36-/m1/s1
SMILES [C@H]([C@H]1CC[C@@H](O1)[C@H]1CC[C@@H](O1)[C@@H](O)CCCCCCCCCC)(O)CCCCCCCCCC[C@H]1C[C@H](C(=O)O1)CC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona bullata Ref.
PlantaeAnnonaceaeAnnona reticulata Ref.
PlantaeAnnonaceaeAnnona squamosa Ref.
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