input word = C00001789

Metabolite InformationStructural formula
Name Yohimbine
Formula C21H26N2O3
Mw 354.19434271
CAS RN 146-48-5
C_ID C00001789 ,
InChIKey BLGXFZZNTVWLAY-BBMZDAOJNA-N
InChICode InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1
SMILES c12c3c([nH]c1[C@H]1N(CC2)C[C@H]2[C@H](C1)[C@H]([C@H](CC2)O)C(=O)OC)cccc3
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens Ref.
PlantaeApocynaceaeCatharanthus roseus Ref.
PlantaeApocynaceaeHaplophyton crooksii L.Benson Ref.
PlantaeApocynaceaeRauvolfia nitida Ref.
PlantaeApocynaceaeRauvolfia serpentina Ref.
PlantaeApocynaceaeRauvolfia vomitoria Ref.
PlantaeApocynaceaeRauvolfia yunnanensis Ref.
PlantaeApocynaceaeRauwolfia nitida Ref.
PlantaeApocynaceaeRauwolfia serpentina Ref.
PlantaeApocynaceaeRauwolfia verticillata Ref.
PlantaeApocynaceaeRauwolfia vomitoria Ref.
PlantaeRubiaceaeCorynanthe johimbe Ref.
PlantaeRubiaceaePausinystalia macroceras Ref.
PlantaeRubiaceaePausinystalia paniculata Ref.
PlantaeRubiaceaePausinystalia yohimbe Ref.
PlantaeRubiaceaePausinystalia yomhinbe Ref.
--Coryanthe johimbe Ref.
--Pausinylstalia yohimbe Ref.
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OrganismCorynanthe johimbe
ReferenceEdited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979).

Sun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998).

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).

Buckingham(Executive Editor), Dictionary of Natural Products, Chapman & Hall, 1994, Vol1-7

1995, Vol8

1996, Vol9

1997, Vol10

1998, Vol11.

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