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SML2859

AB-1

≥98% (HPLC)

Synonym(s):

(1R,4R,5R)-rel-4-(4-Hydroxyphenyl)-6-methyl-3-oxabicyclo[3.3.1]non-6-ene-1-methanol, (1R,4R,5R)-rel-l-4-(5-(Hydroxymethyl)-8-methyl-3-oxabicyclo[3.3.1]non-7-en-2-yl))-phenol

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About This Item

Empirical Formula (Hill Notation):
C16H20O3
CAS Number:
849721-95-5
Molecular Weight:
260.33
UNSPSC Code:
12352200
NACRES:
NA.77
Assay:
≥98% (HPLC)
Form:
powder
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Quality Segment

100

assay

≥98% (HPLC)

form

powder

color

white to beige

solubility

DMSO: 2 mg/mL, clear

storage temp.

−20°C

SMILES string

O1[C@H](C3C[C@](C1)(CC=C3C)CO)c2ccc(cc2)O

InChI

1S/C16H20O3/c1-11-6-7-16(9-17)8-14(11)15(19-10-16)12-2-4-13(18)5-3-12/h2-6,14-15,17-18H,7-10H2,1H3/t14?,15-,16+/m0/s1

InChI key

XXIFNRNIQJKFLP-MERJSTESSA-N

Biochem/physiol Actions

highly selective estrogen receptors ERα and ERβ modulator over G protein-coupled estrogen receptor GPER
AB-1 is a highly selective estrogen receptors ERα and ERβ modulator over G protein-coupled estrogen receptor GPER. AB-1 is an agonist of ER transcriptional activity, but it acts as an antagonist of rapid signaling through ERα.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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