Nordextrorphan
PubChem CID: 11791385
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| Compound Synonyms | Nordextrorphan, (+)-3-Hydroxymorphinan, 15676-23-0, N,O-Didemethyldextromethorphan, Norlevorphanol (+)-form [MI], UNII-AG3VB17119, AG3VB17119, Morphinan-3-ol, (9alpha,13alpha,14alpha)-, (+)-3-Hydroxymorphinan hydrobromide, (1S,9S,10S)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol, Morphinan-3-ol, (9.alpha.,13.alpha.,14.alpha.)-, (+)-Morphinan-3-ol, 9.alpha.,13.alpha.,14.alpha.-Morphinan-3-ol, SCHEMBL4759025, CHEMBL2105152, NORLEVORPHANOL (+)-FORM, 9alpha,13alpha,14alpha-Morphinan-3-ol, (+)-9alpha,13alpha,14alpha-morphinan-3-ol, Q27273909 |
|---|---|
| Topological Polar Surface Area | 32.299 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 18.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 331.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 3.0 |
| Iupac Name | (1S,9S,10S)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol |
| Prediction Hob | 0.0 |
| Xlogp | 2.6 |
| Molecular Formula | C16H21NO |
| Prediction Swissadme | 0.0 |
| Inchi Key | IYNWSQDZXMGGGI-KBMXLJTQSA-N |
| Fcsp3 | 0.625 |
| Logs | -1.789 |
| Rotatable Bond Count | 0.0 |
| Logd | 2.381 |
| Compound Name | Nordextrorphan |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 243.162 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 243.162 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 243.34 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 3.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.2586366666666664 |
| Inchi | InChI=1S/C16H21NO/c18-12-5-4-11-9-15-13-3-1-2-6-16(13,7-8-17-15)14(11)10-12/h4-5,10,13,15,17-18H,1-3,6-9H2/t13-,15+,16+/m1/s1 |
| Smiles | C1CC[C@]23CCN[C@H]([C@H]2C1)CC4=C3C=C(C=C4)O |
| Nring | 4.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Papaver Somniferum (Plant) Rel Props:Source_db:cmaup_ingredients