(+)-piperitol
Chemical Formula:
C20H20O6
Molecular Weight:
356.374 Daltons
Monoisotopic Mass:
356.12598837459996 Daltons
SMILES:
COC5(=CC(C3([CH]4(COC(C2(C=C1(OCOC1=CC=2)))[CH](CO3)4)))=CC=C(O)5)
InChI:
1S/C20H20O6/c1-22-17-6-11(2-4-15(17)21)19-13-8-24-20(14(13)9-23-19)12-3-5-16-18(7-12)26-10-25-16/h2-7,13-14,19-21H,8-10H2,1H3/t13-,14-,19+,20+/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-8921
PubChem (CID):
10247670
Seed:
cpd25490
MetaNetX:
MNXM7909
ChEBI:
141003
KEGG:
C21954