Byakangelicol
Properties
- Molecular formula
- C17H16O6
- Molar mass
- 316.31 g/mol
- Exact mass
- 316.0947 Da
- Melting point
- 106 °C
- logP
- 3.10Crippen estimate
- Polar surface area
- 74.3 Ų
- H-bond donors / acceptors
- 0 / 6
- Rotatable bonds
- 4
- Stereocentres
- Rin SMILES atom order
Identifiers
CAS number
26091-79-2SMILES
COc1c2ccoc2c(OC[C@H]2OC2(C)C)c2oc(=O)ccc12InChIKey
ORBITTMJKIGFNH-LLVKDONJSA-NInChI
InChI=1S/C17H16O6/c1-17(2)11(23-17)8-21-16-14-10(6-7-20-14)13(19-3)9-4-5-12(18)22-15(9)16/h4-7,11H,8H2,1-3H3/t11-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- 7H-Furo[3,2-g][1]benzopyran-7-one, 9-[[(2R)-3,3-dimethyl-2-oxiranyl]methoxy]-4-methoxy-
- 7H-Furo[3,2-g][1]benzopyran-7-one, 9-(2,3-epoxy-3-methylbutoxy)-4-methoxy-, (R)-(+)-
- 7H-Furo[3,2-g][1]benzopyran-7-one, 9-[(3,3-dimethyloxiranyl)methoxy]-4-methoxy-, (R)-
- 7H-Furo[3,2-g][1]benzopyran-7-one, 9-[[(2R)-3,3-dimethyloxiranyl]methoxy]-4-methoxy-
- 9-[[(2R)-3,3-Dimethyl-2-oxiranyl]methoxy]-4-methoxy-7H-furo[3,2-g][1]benzopyran-7-one
- Biacangelicol
Work with Byakangelicol
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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds