5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol

C16H16O5 — CID 10446799

IUPAC5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol
SMILESCOc1cc2c(c(OC)c1O)-c1c(O)cc(O)cc1CC2
InChIInChI=1S/C16H16O5/c1-20-12-6-9-4-3-8-5-10(17)7-11(18)13(8)14(9)16(21-2)15(12)19/h5-7,17-19H,3-4H2,1-2H3
InChIKeyUKUPIFBNLKECPT-UHFFFAOYSA-N
MW288.30 g/mol
LogP2.59
Rot. Bonds2

About 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol

5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol (PubChem CID 10446799) has the molecular formula C16H16O5 and a molecular weight of 288.30 g/mol. Its IUPAC name is 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol.

Molecular Properties

Compound Name5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol
PubChem CID10446799
Molecular FormulaC16H16O5
Molecular Weight288.30 g/mol
Exact Mass288.10
IUPAC Name5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol
SMILESCOc1cc2c(c(OC)c1O)-c1c(O)cc(O)cc1CC2
InChIInChI=1S/C16H16O5/c1-20-12-6-9-4-3-8-5-10(17)7-11(18)13(8)14(9)16(21-2)15(12)19/h5-7,17-19H,3-4H2,1-2H3
InChIKeyUKUPIFBNLKECPT-UHFFFAOYSA-N
XLogP2.59
TPSA79.15 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 52.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4,7-trimethoxy-9,10-dihydrophenanthren-3-ol
CID 24762424
3,5-dimethoxytricyclo[9.4.0.02,7]pentadeca-1(15),2,4,6,11,13-hexaen-4-ol
CID 142005950
3,5,6,7-tetramethoxy-9,10-dihydrophenanthren-2-ol
CID 14049974
(9S)-5-methoxy-9,10-dihydrophenanthrene-2,4,7,9-tetrol
CID 73212405
6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol
CID 91665418
2-methoxy-9,10-dihydrophenanthrene-4,5-diol
CID 11506999
4-chloro-5-methoxybenzene-1,3-diol
CID 130033872
2,10-dihydroxy-3,9,11-trimethoxy-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one
CID 44606418
8-[(5-hydroxy-7-methoxy-9,10-dihydrophenanthren-2-yl)oxy]-6-methoxy-9,10-dihydrophenanthrene-2,5-diol
CID 102026936
(9S,10S)-4,5,15,16-tetramethoxy-9,10-dimethyltricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaene-3,14-diol
CID 163059787
2-hydroxy-1,3,10-trimethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
CID 14413735
3-methoxy-9,10-dihydrophenanthrene-4,5-diol
CID 11499706

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol?
The IUPAC name of 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol (CID 10446799) is 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol.
What is the SMILES notation for 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol?
The canonical SMILES for 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol is COc1cc2c(c(OC)c1O)-c1c(O)cc(O)cc1CC2.
What is the InChIKey of 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol?
The InChIKey is UKUPIFBNLKECPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O5/c1-20-12-6-9-4-3-8-5-10(17)7-11(18)13(8)14(9)16(21-2)15(12)19/h5-7,17-19H,3-4H2,1-2H3.
What are the key properties of 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol?
5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol has a molecular weight of 288.30 g/mol, XLogP of 2.59, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol is sourced from PubChem (CID 10446799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).