input word = C00044302

Metabolite InformationStructural formula
Name Rollitacin
Formula C37H66O8
Mw 638.47576908
CAS RN 187523-67-7
C_ID C00044302 ,
InChIKey SWLPIUHJTSWWOJ-VWXKJXCLNA-N
InChICode InChI=1S/C37H66O8/c1-3-4-13-18-29(38)30(39)20-16-21-32(41)34-23-25-36(45-34)35-24-22-33(44-35)31(40)19-15-12-10-8-6-5-7-9-11-14-17-28-26-27(2)43-37(28)42/h26-27,29-36,38-41H,3-25H2,1-2H3/t27-,29+,30-,31+,32-,33+,34+,35+,36+/m0/s1
SMILES CCCCC[C@H]([C@H](CCC[C@@H]([C@@H]1O[C@H](CC1)[C@@H]1O[C@H](CC1)[C@@H](CCCCCCCCCCCCC1=C[C@@H](OC1=O)C)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeRollinia mucosa Ref.
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