(4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one

C7H8O5 — CID 138756296

IUPAC(4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one
SMILESO=C1C=C2C(O1)[C@H](O)OC[C@@H]2O
InChIInChI=1S/C7H8O5/c8-4-2-11-7(10)6-3(4)1-5(9)12-6/h1,4,6-8,10H,2H2/t4-,6?,7+/m0/s1
InChIKeyRUJWBBAVRBNHNV-WTRRFROCSA-N
MW172.14 g/mol
LogP-1.45
Rot. Bonds

About (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one

(4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one (PubChem CID 138756296) has the molecular formula C7H8O5 and a molecular weight of 172.14 g/mol. Its IUPAC name is (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one.

Molecular Properties

Compound Name(4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one
PubChem CID138756296
Molecular FormulaC7H8O5
Molecular Weight172.14 g/mol
Exact Mass172.04
IUPAC Name(4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one
SMILESO=C1C=C2C(O1)[C@H](O)OC[C@@H]2O
InChIInChI=1S/C7H8O5/c8-4-2-11-7(10)6-3(4)1-5(9)12-6/h1,4,6-8,10H,2H2/t4-,6?,7+/m0/s1
InChIKeyRUJWBBAVRBNHNV-WTRRFROCSA-N
XLogP-1.45
TPSA75.99 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.14
LogP ≤ 5-1.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one with MolForge

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Launch Full Analysis

Related Compounds

Cikruxxvsdqfhd-uhfffaoysa-
CID 10631260
2-hydroxy-3-(6-hydroxy-5-methyl-3,6-dihydro-2H-pyran-2-yl)-2H-furan-5-one
CID 10954847
2-hydroxy-3-(6-hydroxy-3,6-dihydro-2H-pyran-2-yl)-2H-furan-5-one
CID 10608003
2(5H)-Furanone, 4-(3,6-dihydro-5-methyl-2H-pyran-2-yl)-5-hydroxy-
CID 11063341
Aspersclerolide B
CID 146682629
4-((4-Hydroxy-2-oxo-4,6,7,7a-tetrahydro-2H-furo[3,2-c]pyran-7-yl)oxy)-4-oxobutanoic acid
CID 23729185
4-(1,2,3-Trihydroxypropyl)-2(5h)-furanone
CID 85221597
8-Hydroxy-3,3-dimethyl-2,4,7,12-tetraoxatricyclo[7.3.0.01,5]dodec-9-en-11-one
CID 101109449
2-hydroxy-3-[1-hydroxy-2-(2-methoxyethoxymethoxy)ethyl]-2H-furan-5-one
CID 19885992
(Z)-3-[(2R,3R,7S,7aS)-3,5-dihydroxy-7-methyl-3,5,7,7a-tetrahydro-2H-furo[3,4-b]pyran-2-yl]prop-2-enoic acid
CID 126513613
3-[(4R,5R)-5-hydroxy-2,2-dimethyl-1,3-dioxan-4-yl]-2H-furan-5-one
CID 10632404
3-[(1R,2R)-1,2,3-trihydroxypropyl]-2H-furan-5-one
CID 10654808

Frequently Asked Questions

What is the IUPAC name of (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one?
The IUPAC name of (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one (CID 138756296) is (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one.
What is the SMILES notation for (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one?
The canonical SMILES for (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one is O=C1C=C2C(O1)[C@H](O)OC[C@@H]2O.
What is the InChIKey of (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one?
The InChIKey is RUJWBBAVRBNHNV-WTRRFROCSA-N. The full InChI is InChI=1S/C7H8O5/c8-4-2-11-7(10)6-3(4)1-5(9)12-6/h1,4,6-8,10H,2H2/t4-,6?,7+/m0/s1.
What are the key properties of (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one?
(4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one has a molecular weight of 172.14 g/mol, XLogP of -1.45, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,7R)-4,7-dihydroxy-4,5,7,7a-tetrahydrofuro[2,3-c]pyran-2-one is sourced from PubChem (CID 138756296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).