input word = C00023420

Metabolite InformationStructural formula
Name Methyl 15-cinnamoyloxy-7-labden-17-oate
Formula C30H42O4
Mw 466.30830983
CAS RN
C_ID C00023420 ,
InChIKey PTBIPOPCPDBHRO-VKVDQQBUNA-N
InChICode InChI=1S/C30H42O4/c1-22(18-21-34-27(31)17-13-23-10-7-6-8-11-23)12-15-25-24(28(32)33-5)14-16-26-29(2,3)19-9-20-30(25,26)4/h6-8,10-11,13-14,17,22,25-26H,9,12,15-16,18-21H2,1-5H3/b17-13+/t22-,25-,26-,30-/m1/s1
SMILES C1CC(C)([C@@H]2[C@](C1)([C@@H](C(=CC2)C(=O)OC)CC[C@H](CCOC(=O)/C=C/c1ccccc1)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCistaceaeHalimium viscosum Ref.
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