input word = C00040507

Metabolite InformationStructural formula
Name Toosendanin
Formula C30H38O11
Mw 574.24141206
CAS RN 58812-37-6
C_ID C00040507 ,
InChIKey NAHTXVIXCMUDLF-WWAUTWNBNA-N
InChICode InChI=1S/C30H38O11/c1-13(31)39-20-10-19(34)29-12-38-25(36)26(20,3)17(29)9-18(33)28(5)23(29)22(35)24(40-14(2)32)27(4)16(15-6-7-37-11-15)8-21-30(27,28)41-21/h6-7,11,16-21,23-25,33-34,36H,8-10,12H2,1-5H3/t16-,17?,18+,19-,20+,21+,23?,24-,25+,26+,27+,28+,29?,30-/m0/s1
SMILES C1(=O)[C@H]2[C@]([C@@]34[C@@]([C@H]1OC(=O)C)([C@@H](C[C@H]3O4)c1cocc1)C)([C@@H](C[C@@H]1[C@@]32[C@H](C[C@H]([C@]1(C)[C@@H](OC3)O)OC(=O)C)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeMelia azedarach Ref.
PlantaeMeliaceaeMelia toosendan Sieb.et Zuce. Ref.
PlantaeMeliaceaeToona sinensis Ref.
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OrganismToona sinensis
ReferenceJi, et al., Pharmacological Action and Application of Available Composition of Traditional Chinese Medicine, Heilongjiang Science and technology Press, Heilongjiang, (1995).

Chinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999).

Tada, et al., Phytochemistry, 51, (1999), 787.

Ou, et al., Brief Handbook of Components of Traditional Chinese Medicines, The People's Medical Publishing House, Beijing, (2003).

Chang, et al., Dictionary of Chemistry, Science Press, Beijing, (2008)