input word = C00040693

Metabolite InformationStructural formula
Name Xerophilusin VIII
(-)-Xerophilusin VIII
Formula C22H30O9
Mw 438.18898256
CAS RN 949933-04-4
C_ID C00040693 ,
InChIKey HBHDFCQEBUVCSW-JNBQCQIZNA-N
InChICode InChI=1S/C22H30O9/c1-9-11-4-12(24)15-20-8-31-22(29,21(15,6-11)17(9)27)18(28)16(20)19(3,7-30-10(2)23)13(25)5-14(20)26/h11-16,18,24-26,28-29H,1,4-8H2,2-3H3/t11-,12-,13-,14-,15+,16-,18+,19-,20+,21+,22-/m1/s1
SMILES [C@@H]1([C@]23[C@@H]([C@@]([C@@H](C1)O)(COC(=O)C)C)[C@@H]([C@@]([C@@]14[C@H]2[C@@H](C[C@@H](C(=C)C1=O)C4)O)(O)OC3)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon xerophilus Ref.
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