input word = C00028401

Metabolite InformationStructural formula
Name Isojervine
Formula C27H39NO3
Mw 425.29299412
CAS RN 2303-30-2
C_ID C00028401 ,
InChIKey JEOLXONPOHXANX-IJTPYDIFNA-N
InChICode InChI=1S/C27H39NO3/c1-14-11-22(30)25(28-13-14)16(3)19-7-8-20-21-6-5-17-12-18(29)9-10-27(17,4)24(21)26(31)23(20)15(19)2/h5,14,16,18,20,22-23,25,28-30H,6-13H2,1-4H3/t14-,16-,18-,20-,22+,23-,25-,27-/m0/s1
SMILES CC1=C([C@H](C)[C@@H]2NC[C@@H](C)C[C@H]2O)CC[C@H]2C3=C(C(=O)[C@@H]12)[C@@]1(C)CC[C@H](O)CC1=CC3
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeMelanthiaceaeVeratrum lobelianum Ref.
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OrganismVeratrum lobelianum
ReferenceFoldesiova,Farm.Obz.,64,(1995),193