marylaurencinol D

Compound Structure:

Synonyms:

2,4-dimethoxy-9,10-dihydrophenanthrene-3,5-diol; Marylaurencinols A

Compound ID:

NMPC-1228

PubChem ID:

Molecular Formula:

C16H16O4

Canonical SMILES:

COC1=C(C(=C2C(=C1)CCC3=C2C(=CC=C3)O)OC)O

InChIKey:

HPDSFXKGXUGRME-UHFFFAOYSA-N

About the compound:

Properties:

Chemical and Physical Properties

Computed Properties

Property Name	Property Value
Molecular Weight	272.29 g/mol
XLogP3-AA	3.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	272.10485899 g/mol
Monoisotopic Mass	272.10485899 g/mol
Topological Polar Surface Area	58.9Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	334
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source: PubChem

Source Species:

Euphorbia deightonii

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