input word = C00050635

Metabolite InformationStructural formula
Name 15alpha-Hydroxytomatidenol
Formula C27H43NO3
Mw 429.32429425
CAS RN 7755-31-9
C_ID C00050635
InChIKey NDRFXTSOOBKFGG-RTTIAOFYNA-N
InChICode InChI=1S/C27H43NO3/c1-15-7-12-27(28-14-15)16(2)21-24(31-27)23(30)22-19-6-5-17-13-18(29)8-10-25(17,3)20(19)9-11-26(21,22)4/h5,15-16,18-24,28-30H,6-14H2,1-4H3/t15-,16-,18-,19+,20-,21-,22+,23+,24+,25-,26+,27-/m0/s1
SMILES C[C@H]1CC[C@]2(NC1)O[C@H]1[C@H](O)[C@H]3[C@@H]4CC=C5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum dulcamara Ref.
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