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(4aR,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydrochrysen-1-one

(4aR,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydrochrysen-1-one structure

CAS No:
2384-20-5
Formula:
C20H24O2
Chemical Name:
(4aR,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydrochrysen-1-one
Synonyms:
3-Methoxy-D-homoestra-1,3,5(10),8-tetraen-17a-one;C15124;(4as,12as)-8-methoxy-12a-methyl-3,4,4a,5,6,11,12,12a-octahydrochrysen-1(2h)-one;CHEBI:79642;CTK4F2401;DTXSID00291799;NSC78046;ZINC4895967;NSC-78046;Q27148764

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Description

3-Methoxy-D-homoestra-1,3,5(10),8-tetraen-17a-one is a tetracyclic diterpenoid.

(4aR,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydrochrysen-1-one Basic Attributes

Molecular Weight：

296.40336

Exact Mass：

296.178

NSC Number：

78046

DSSTox ID：

DTXSID00291799

Characteristics

PSA：

26.3

XLogP3：

3.3

Density：

1.14±0.1 g/cm3(Predicted)

Melting Point：

127-131 °C

Computed Properties

Molecular Weight:296.4
XLogP3:3.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:296.177630004
Monoisotopic Mass:296.177630004
Topological Polar Surface Area:26.3
Heavy Atom Count:22
Complexity:506
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (4aR,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydrochrysen-1-one

Description
Basic Attributes
Characteristics
Computed Properties

(4aR,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydrochrysen-1-one

SDS

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