input word = C00057341

Metabolite InformationStructural formula
Name Robustocin
Formula C35H62O5
Mw 562.45972509
CAS RN 314243-09-9
C_ID C00057341
InChIKey XINHKDZHJWEKBB-PLOBYEPISA-N
InChICode InChI=1S/C35H62O5/c1-3-4-5-6-7-8-9-10-11-12-16-19-22-31(36)32-25-26-34(40-32)33-24-23-30(39-33)21-18-15-13-14-17-20-29-27-28(2)38-35(29)37/h27-28,30-34,36H,3-26H2,1-2H3/t28-,30+,31+,32+,33-,34-/m0/s1
SMILES CCCCCCCCCCCCCC[C@@H](O)[C@H]1CC[C@@H]([C@@H]2CC[C@@H](CCCCCCCC3=C[C@H](C)OC3=O)O2)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona muricata Ref.
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OrganismAnnona muricata
ReferenceWoo, M.H. et al., J. Nat. Prod., 1995, 58, 1533-1542 (Asimilobin)