Glycozolinine
PubChem CID: 11041703
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| Compound Synonyms | GLYCOZOLININE, 6-methyl-9H-carbazol-3-ol, 5257-08-9, Glycozolinol, Carbazol-3-ol, 6-methyl-, 6-Methyl-9H-carbazol-3-ol, 3-Methyl-6-hydroxycarbazole, Glycozolinine, Glycozolinol, 6-hydroxy-3-methyl-carbazole, CHEMBL2260670, 9H-Carbazol-3-ol, 6-methyl-, DTXSID601035153, FAA25708, AKOS032948509, FS-9971, CS-0024521, B0005-188630 |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 36.0 |
| Hydrogen Bond Donor Count | 2.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | C1CCC2C(C1)CC1CCCCC12 |
| Np Classifier Class | Carbazole alkaloids |
| Deep Smiles | Ccccccc6)cccO)ccc6[nH]9 |
| Heavy Atom Count | 15.0 |
| Classyfire Class | Indoles and derivatives |
| Scaffold Graph Node Level | C1CCC2C(C1)NC1CCCCC12 |
| Classyfire Subclass | Carbazoles |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 243.0 |
| Database Name | imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 6-methyl-9H-carbazol-3-ol |
| Veber Rule | True |
| Classyfire Superclass | Organoheterocyclic compounds |
| Xlogp | 3.4 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C13H11NO |
| Scaffold Graph Node Bond Level | c1ccc2c(c1)[nH]c1ccccc12 |
| Inchi Key | HGWWJXCROVKODY-UHFFFAOYSA-N |
| Silicos It Class | Moderately soluble |
| Rotatable Bond Count | 0.0 |
| Synonyms | glycozolinine, glycozolinol, glycozolinol(glycozolinine) |
| Esol Class | Soluble |
| Functional Groups | cO, c[nH]c |
| Compound Name | Glycozolinine |
| Exact Mass | 197.084 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 197.084 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 197.23 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C13H11NO/c1-8-2-4-12-10(6-8)11-7-9(15)3-5-13(11)14-12/h2-7,14-15H,1H3 |
| Smiles | CC1=CC2=C(C=C1)NC3=C2C=C(C=C3)O |
| Np Classifier Biosynthetic Pathway | Alkaloids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Tryptophan alkaloids |
- 1. Outgoing r'ship
FOUND_INto/from Glycosmis Pentaphylla (Plant) Rel Props:Reference:ISBN:9788172360818; ISBN:9788185042114