input word = C00037491

Metabolite InformationStructural formula
Name Meliacinol
(+)-Meliacinol
Formula C32H42O8
Mw 554.28796832
CAS RN 263758-73-2
C_ID C00037491 ,
InChIKey JAOOSUNNEZDAPO-ZKDFNWMRNA-N
InChICode InChI=1S/C32H42O8/c1-16(2)17(3)28(36)39-22-13-21(33)30(5)15-38-24-25(30)32(22,7)19-8-10-29(4)20(31(19,6)26(24)35)12-23(34)40-27(29)18-9-11-37-14-18/h9,11-12,14,19,21-22,24-27,33,35H,8,10,13,15H2,1-7H3/t19-,21+,22-,24+,25-,26+,27-,29+,30+,31+,32-/m0/s1
SMILES [C@H]1(OC(=O)C=C2[C@]1(CC[C@H]1[C@]2([C@@H]([C@H]2[C@@H]3[C@@]1([C@H](C[C@H]([C@]3(CO2)C)O)OC(=O)C(=C(C)C)C)C)O)C)C)c1ccoc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta indica Ref.
--Azadiractica indica Ref.
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