input word = C00063525

Metabolite InformationStructural formula
Name 21-Hydroxycyclolochnerine
Formula C20H24N2O3
Mw 340.17869265
CAS RN 96688-58-3
C_ID C00063525
InChIKey WDGLSKZTHGGYAU-WVIKODBESA-N
InChICode InChI=1S/C20H24N2O3/c1-9-18-12-6-17-19-13(11-5-10(24-2)3-4-15(11)21-19)7-16(14(12)8-25-9)22(17)20(18)23/h3-5,9,12,14,16-18,20-21,23H,6-8H2,1-2H3/t9-,12+,14+,16-,17-,18-,20?/m0/s1
SMILES COc1ccc2[nH]c3c(c2c1)CC1C2COC(C)C4C2CC3N1C4O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCatharanthus roseus Ref.
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