input word = C00045057

Metabolite InformationStructural formula
Name Salzmanolin
Formula C37H66O9
Mw 654.47068371
CAS RN 552868-02-7
C_ID C00045057 ,
InChIKey BCWHXZZDBFJGAE-UHFFFAOYNA-N
InChICode InChI=1S/C37H66O9/c1-3-4-13-18-28(38)29(39)20-16-21-30(40)33-22-23-34(45-33)35-25-32(42)36(46-35)31(41)19-15-12-10-8-6-5-7-9-11-14-17-27-24-26(2)44-37(27)43/h24,26,28-36,38-42H,3-23,25H2,1-2H3/t26-,28+,29-,30-,31-,32-,33+,34-,35+,36+/m1/s1
SMILES CCCCC[C@H](O)[C@H](O)CCC[C@@H](O)[C@@H]1CC[C@@H](O1)[C@@H]1C[C@H]([C@@H](O1)[C@H](O)CCCCCCCCCCCCC1=C[C@H](OC1=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona salzmannii Ref.
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