input word = C00039171

Metabolite InformationStructural formula
Name Espinendiol A
Formula C30H52O2
Mw 444.3967309
CAS RN 122741-45-1
C_ID C00039171 ,
InChIKey MMVRRFYBKHIWCR-LHZXNYSGNA-N
InChICode InChI=1S/C30H52O2/c1-20(2)22-11-12-23-26(22,5)15-17-29(8)24-13-14-30(32,21(3)4)25(10-9-19-31)27(24,6)16-18-28(23,29)7/h20,22-25,31-32H,3,9-19H2,1-2,4-8H3/t22-,23-,24+,25+,26-,27+,28+,29-,30-/m1/s1
SMILES C=C(C)[C@]1(O)CC[C@H]2[C@@](C)(CC[C@@]3(C)[C@@H]4CC[C@H](C(C)C)[C@@]4(C)CC[C@]23C)[C@@H]1CCCO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeEuphorbia supina Rafin Ref.
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