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Monbarbatain C

CAT: 0013-GTR19243067-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19243067-02Size:10 mg
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Description
Monbarbatain C is a natural product for life science research. It has demonstrated bioactivity in vitro, making it a candidate for studies in pharmacology and natural product chemistry.
CAS Number
1334310-62-1
Smiles
OC1=CC=C2C (C=CC=3C2=C (O) C=C (OC) C3C=4C=C5C (=CC4O) CCC6=CC (OC) =CC (O) =C56) =C1
Molecular Formula
C30H24O6
Molecular Weight
480.51
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

8-(2,5-Dihydroxy-7-methoxy-9,10-dihydrophenanthren-3-yl)-7-methoxyphenanthrene-2,5-diol

8-(2,5-Dihydroxy-7-methoxy-9,10-dihydrophenanthren-3-yl)-7-methoxyphenanthrene-2,5-diol has been reported in Bulbophyllum crabro and Eriodes barbata with data available.

CAS Number1334310-62-1
PubChem CID162968979
IUPAC Name8-(2,5-dihydroxy-7-methoxy-9,10-dihydrophenanthren-3-yl)-7-methoxyphenanthrene-2,5-diol
Molecular FormulaC30H24O6
Molecular Weight480.5
XLogP6.5
Topological Polar Surface Area99.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count36
Formal Charge0
Complexity762
SMILES
COC1=CC2=C(C3=CC(=C(C=C3CC2)O)C4=C(C=C(C5=C4C=CC6=C5C=CC(=C6)O)O)OC)C(=C1)O
InChI
InChI=1S/C30H24O6/c1-35-19-10-17-4-3-16-11-24(32)23(13-22(16)28(17)25(33)12-19)30-21-7-5-15-9-18(31)6-8-20(15)29(21)26(34)14-27(30)36-2/h5-14,31-34H,3-4H2,1-2H3
InChIKey
GECLWMVZGSZWMK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 8-(2,5-Dihydroxy-7-methoxy-9,10-dihydrophenanthren-3-yl)-7-methoxyphenanthrene-2,5-diol
CAS: 1334310-62-1
CID: 162968979
Formula: C30H24O6
MW: 480.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight480.5
XLogP36.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass480.15728848
Monoisotopic Mass480.15728848
Topological Polar Surface Area99.4 Ų
Heavy Atom Count36
Formal Charge0
Complexity762
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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