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(1S,4aS,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydro-1H-chrysen-1-ol

(1S,4aS,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydro-1H-chrysen-1-ol structure

CAS No:
19882-46-3
Formula:
C20H26O2
Chemical Name:
(1S,4aS,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydro-1H-chrysen-1-ol
Synonyms:
UNII-N449506EYR;19882-46-3;N449506EYR;1,2,3,4,4a,5,6,11,12,12a-Decahydro-8-methoxy-12a-methyl-1-chrysenol;3-Methoxy-D-homoestra-1,3,5(10),8-tetraen-17abeta-ol;C15142;CHEBI:79660;DTXSID90941736;NSC78045;ZINC4895966;NSC 78045;NSC-78045;Q27148782;8-Methoxy-12a-methyl-1,2,3,4,4a,5,6,11,12,12a-decahydrochrysen-1-ol

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Description

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

(1S,4aS,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydro-1H-chrysen-1-ol Basic Attributes

Molecular Weight：

298.4 g/mol

Exact Mass：

298.193280068 g/mol

UNII：

N449506EYR

NSC Number：

78045

Characteristics

PSA：

29.5 Å²

Computed Properties

Molecular Weight:298.4
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:298.193280068
Monoisotopic Mass:298.193280068
Topological Polar Surface Area:29.5
Heavy Atom Count:22
Complexity:468
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (1S,4aS,12aS)-8-methoxy-12a-methyl-2,3,4,4a,5,6,11,12-octahydro-1H-chrysen-1-ol

Description
Basic Attributes
Characteristics
Computed Properties

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