input word = C00058700

Metabolite InformationStructural formula
Name Rhombenone
Formula C29H46O4
Mw 458.33960996
CAS RN 191542-64-0
C_ID C00058700
InChIKey PEOLFRGMBDOWAZ-IQWDMFAISA-N
InChICode InChI=1S/C29H46O4/c1-18(30)9-8-14-29(7,33)20-12-16-27(5)19(20)10-11-22-26(4)15-13-23(32)25(2,3)24(26)21(31)17-28(22,27)6/h8-9,19-22,24,31,33H,10-17H2,1-7H3/b9-8+/t19-,20+,21+,22-,24+,26-,27-,28-,29+/m1/s1
SMILES CC(=O)/C=C/C[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3[C@@H](O)C[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaeHedera rhombea Ref.
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OrganismHedera rhombea
ReferenceK.-S. Kim et al., Chem. Abs., (1997), 127, 92665.