input word = C00003754

Metabolite InformationStructural formula
Name Sapelin A
Formula C30H50O4
Mw 474.37091008
CAS RN 26790-93-2
C_ID C00003754 ,
InChIKey YHJGJKRPDMVIKU-UZTRWKRONA-N
InChICode InChI=1S/C30H50O4/c1-26(2)23-9-8-21-20(28(23,5)13-12-24(26)32)11-15-29(6)19(10-14-30(21,29)7)18-16-22(31)25(34-17-18)27(3,4)33/h8,18-20,22-25,31-33H,9-17H2,1-7H3/t18-,19+,20+,22-,23+,24-,25-,28-,29+,30-/m1/s1
SMILES C1[C@H](C([C@H]2[C@](C1)([C@@H]1C(=CC2)[C@@]2([C@@](CC1)([C@@H](CC2)[C@@H]1C[C@H]([C@@H](OC1)C(C)(C)O)O)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeEntandrophragma cylindricum Ref.
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OrganismEntandrophragma cylindricum
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter59