input word = C00029664

Metabolite InformationStructural formula
Name Almunequin
(+)-Alumunequin
Formula C37H66O8
Mw 638.47576908
CAS RN 125620-82-8
C_ID C00029664 ,
InChIKey HKIHGTSLUYNNHM-OYVSIAMLNA-N
InChICode InChI=1S/C37H66O8/c1-3-4-5-12-16-29(38)17-14-19-31(39)35-24-25-36(45-35)33(41)22-21-32(40)34-23-20-30(44-34)18-13-10-8-6-7-9-11-15-28-26-27(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 O1[C@H](C=C(C1=O)CCCCCCCCC[C@H]1CC[C@@H](O1)[C@@H](CC[C@@H]([C@@H]1O[C@H](CC1)[C@H](CCC[C@@H](CCCCCC)O)O)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona cherimola Ref.
PlantaeAnnonaceaeAnnona cherimolia Ref.
PlantaeAnnonaceaeAnnona salzmanii Ref.
PlantaeAnnonaceaeAnnona spinescens Ref.
PlantaeAnnonaceaeAnnona squamosa Ref.
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