input word = C00048110

Metabolite InformationStructural formula
Name Sculponin H
(-)-Sculponin H
Formula C20H24O7
Mw 376.15220312
CAS RN 1182713-63-8
C_ID C00048110 ,
InChIKey SJWINKDBDHFDEN-DNYAOCMUNA-N
InChICode InChI=1S/C20H24O7/c1-8-9-5-10(21)12-19(6-9,14(8)22)17(24)26-11-3-4-18(2)13-15(27-16(18)23)25-7-20(11,12)13/h9-13,15-16,21,23H,1,3-7H2,2H3/t9-,10-,11+,12-,13-,15+,16+,18-,19+,20+/m1/s1
SMILES O=C1C(=C)[C@@H]2C[C@H]([C@@H]3[C@@]1(C(=O)O[C@@H]1[C@@]43[C@H]3[C@@](CC1)([C@H](O[C@@H]3OC4)O)C)C2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon sculponeatus Ref.
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