input word = C00048103

Metabolite InformationStructural formula
Name Sculponeatin B
(-)-Sculponeatin B
Formula C20H24O6
Mw 360.1572885
CAS RN 85287-60-1
C_ID C00048103 ,
InChIKey VITOUEAQSWAQLD-WKZRJPDYNA-N
InChICode InChI=1S/C20H24O6/c1-9-10-5-11(21)13-19(6-10,15(9)22)17(23)26-12-3-4-18(2)7-24-16-14(18)20(12,13)8-25-16/h10-14,16,21H,1,3-8H2,2H3/t10-,11-,12+,13-,14-,16+,18+,19+,20+/m1/s1
SMILES O1[C@@H]2[C@@]3([C@H]4[C@@]5(C1=O)C[C@@H](C[C@H]4O)C(=C)C5=O)[C@H]1[C@@](CC2)(CO[C@H]1OC3)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon sculponeata Ref.
PlantaeLabiataeIsodon sculponeatus Ref.
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