3-Hydroxy-Morindone

CAT: 1266-JH918813Size: 1 EachDry Ice: NoHazardous: No

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CAT#:1266-JH918813Size:1 Each

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CAS Number

80368-74-7

Molecular Formula

C15H10O6

Molecular Weight

286.24

Chemical Information

3-Hydroxymorindone

3-hydroxymorindone has been reported in Pentas suswaensis and Morinda citrifolia with data available.

CAS Number	80368-74-7
PubChem CID	86012754
IUPAC Name	1,3,5,6-tetrahydroxy-2-methylanthracene-9,10-dione
Molecular Formula	C15H10O6
Molecular Weight	286.24
XLogP	2.9
Topological Polar Surface Area	115
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	0
Heavy Atom Count	21
Formal Charge	0
Complexity	463

SMILES

CC1=C(C=C2C(=C1O)C(=O)C3=C(C2=O)C(=C(C=C3)O)O)O

InChI

InChI=1S/C15H10O6/c1-5-9(17)4-7-11(12(5)18)13(19)6-2-3-8(16)15(21)10(6)14(7)20/h2-4,16-18,21H,1H3

InChIKey

JCZGUFVZKUDRMM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 80368-74-7

CID: 86012754

Formula: C15H10O6

MW: 286.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	286.24
XLogP3	2.9
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	0
Exact Mass	286.04773803
Monoisotopic Mass	286.04773803
Topological Polar Surface Area	115 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	463
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

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279595-01	3-Hydroxy-3-Methylazetidine
T50100-01	3-hydroxy-3-phenylpentanamide
OR308125	3-Hydroxy-3-methylpiperidine
sc-266680	3-Hydroxy-3'-methoxyflavone
sc-226093	3-Hydroxy-3-methylbutyronitrile
sc-226094	3-Hydroxy-3-phenylpropionitrile