input word = C00040363

Metabolite InformationStructural formula
Name Squafosacin B
(+)-Squafosacin B
Formula C37H68O7
Mw 624.49650453
CAS RN 1017587-47-1
C_ID C00040363 ,
InChIKey NNWVJTKJMJKOEU-KYQQURSNNA-N
InChICode InChI=1S/C37H68O7/c1-3-4-5-17-22-31(38)32(39)23-18-14-15-20-25-34(41)36-27-26-35(44-36)33(40)24-19-13-11-9-7-6-8-10-12-16-21-30-28-29(2)43-37(30)42/h28-29,31-36,38-41H,3-27H2,1-2H3/t29-,31+,32+,33+,34+,35+,36+/m0/s1
SMILES [C@@H]1(CC[C@@H](O1)[C@@H](CCCCCC[C@H]([C@@H](CCCCCC)O)O)O)[C@@H](CCCCCCCCCCCCC1=C[C@@H](OC1=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona squamosa Ref.
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OrganismAnnona squamosa
ReferenceLiaw,J.Nat.Prod.,71,(2008),764