input word = C00040690

Metabolite InformationStructural formula
Name Xerophilusin V
(-)-Xerophilusin V
Formula C20H30O7
Mw 382.19915331
CAS RN 950181-60-9
C_ID C00040690 ,
InChIKey JVUNNAVCBNLWTO-MWPQZJSKNA-N
InChICode InChI=1S/C20H30O7/c1-9-10-3-4-11-18-8-27-20(26,19(11,14(9)23)15(10)24)16(25)13(18)17(2,7-21)6-5-12(18)22/h10-16,21-26H,1,3-8H2,2H3/t10-,11-,12+,13+,14+,15+,16-,17-,18+,19?,20+/m0/s1
SMILES [C@@H]1([C@]23[C@@H]([C@@](CC1)(CO)C)[C@@H]([C@@]([C@]14[C@H]2CC[C@@H](C(=C)[C@H]1O)[C@H]4O)(O)OC3)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon xerophilus Ref.
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