input word = C00045759

Metabolite InformationStructural formula
Name Cespitularin H
(-)-Cespitularin H
Formula C20H28O3
Mw 316.20384476
CAS RN 473911-48-7
C_ID C00045759 ,
InChIKey AXOPQHQNFSMCKW-QCGHCKFRNA-N
InChICode InChI=1S/C20H28O3/c1-11-5-6-13-7-8-15-17(20(13,3)4)19(23)16(18(15)22)12(2)10-14(21)9-11/h5,12-13,16,18,22H,6-10H2,1-4H3/b11-5-/t12-,13+,16-,18-/m0/s1
SMILES C12=C3CC[C@H](C1(C)C)C/C=C(\CC(=O)C[C@@H]([C@H](C2=O)[C@H]3O)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaXeniidaeCespitularia hypotentaculata Ref.
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