FL63ACNC0003

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Upper classes : FL Flavonoid : FL6 Flavan : FL63 Flavan 3-ol :  FL63AC Catechin and Epicatechin (75 pages) :  FL63ACNC Flavonoid substituted by complex substituent (5 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	142542-77-6
KEGG	{{{KEGG}}}
KNApSAcK	C00008971
CDX file
MOL file	FL63ACNC0003.mol

Pilosanol B
Structural Information
Systematic Name	(1S) -1,2,3,4,4aalpha,5,6,8a-Octahydro-4alpha- [ (Z) -5-hydroxy-3-hydroxymethyl-3-pentenyl ] -8,8abeta-bis (hydroxymethyl) -3beta,4-dimethylnaphthalen-1beta-ol
Common Name	Pilosanol B (1S) -1,2,3,4,4aalpha,5,6,8a-Octahydro-4alpha- [ (Z) -5-hydroxy-3-hydroxymethyl-3-pentenyl ] -8,8abeta-bis (hydroxymethyl) -3beta,4-dimethylnaphthalen-1beta-ol
Symbol
Formula	C28H30O10
Exact Mass	526.18389718
Average Mass	526.5318
SMILES	c(c1)c(c(cc1[C@H]([C@H]2O)Oc(c3Cc(c(O)4)c(c(c(OC)c(C)4)C(=O)C(C)C)O)c(c(cc3O)O)C2)O)O
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms

Species Information

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Agrimonia pilosa FL63ACNC0003 See above. Kasai_S et al. 1992