input word = C00023440

Metabolite InformationStructural formula
Name ent-13,14-Epoxy-15-hydroxy-1(10)-halimen-18-oic acid
Formula C20H32O4
Mw 336.23005951
CAS RN 128988-50-1
C_ID C00023440 ,
InChIKey PXQKBOHFGHAWEW-GXXXQBJPNA-N
InChICode InChI=1S/C20H32O4/c1-13-7-8-15-14(6-5-9-19(15,3)17(22)23)18(13,2)10-11-20(4)16(12-21)24-20/h6,13,15-16,21H,5,7-12H2,1-4H3,(H,22,23)/t13-,15+,16-,18+,19+,20-/m1/s1
SMILES C1C[C@@]([C@@H]2C(=C1)[C@]([C@@H](CC2)C)(CC[C@@]1([C@@H](CO)O1)C)C)(C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCistaceaeHalimium viscosum Ref.
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OrganismHalimium viscosum
ReferenceUrones,Phytochem.,29,(1990),1247