input word = C00036905

Metabolite InformationStructural formula
Name Cipadesin
(-)-Cipadesin
Formula C32H42O8
Mw 554.28796832
CAS RN 329763-51-1
C_ID C00036905 ,
InChIKey VJNCOPXREONOMO-AGCWUIIDNA-N
InChICode InChI=1S/C32H42O8/c1-8-17(2)29(36)40-28-20-13-19-21(32(6,26(20)35)23(30(28,3)4)15-24(33)37-7)9-11-31(5)22(19)14-25(34)39-27(31)18-10-12-38-16-18/h10,12-13,16-17,20-23,27-28H,8-9,11,14-15H2,1-7H3/t17-,20+,21-,22-,23-,27-,28+,31+,32+/m0/s1
SMILES [C@@H]1(C([C@@H]([C@]2([C@@H]3C(=C[C@@H]1C2=O)[C@H]1[C@@](CC3)([C@@H](OC(=O)C1)c1ccoc1)C)C)CC(=O)OC)(C)C)OC(=O)[C@H](CC)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeCipadessa baccifera (Roth) Miq. Ref.
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OrganismCipadessa baccifera (Roth) Miq.
ReferenceLuo,Phytochem.,55,(2000),867