324421 <common-name>(1r,9s,13r)-10-[2-(1,3-dioxan-2-yl)ethyl]-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol</common-name> <description>(1r,9s,13r)-10-[2-(1,3-dioxan-2-yl)ethyl]-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol is a chemical compound with the formula C20H29NO3. It has an average molecular weight of 331.40 g/mol.</description> <cas nil="true"/> <pubchem-id>3076348</pubchem-id> <chemical-formula>C20H29NO3</chemical-formula> <weight>331.4</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-08-30T01:37:12Z</created-at> <updated-at type="dateTime">2026-08-30T01:37:12Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CC1C2CC3=C(C1(CCN2CCC4OCCCO4)C)C=C(C=C3)O</moldb-smiles> <moldb-formula>C20H29NO3</moldb-formula> <moldb-inchi>InChI=1S/C20H29NO3/c1-14-18-12-15-4-5-16(22)13-17(15)20(14,2)7-9-21(18)8-6-19-23-10-3-11-24-19/h4-5,13-14,18-19,22H,3,6-12H2,1-2H3/t14-,18-,20+/m0/s1</moldb-inchi> <moldb-inchikey>MEIRVPWPDUXAER-ADLFWFRXSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">331.2147438</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.2</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM320314</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>(1r,9s,13r)-10-[2-(1,3-dioxan-2-yl)ethyl]-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Alkaloids and derivatives</superklass> <klass>6,7-benzomorphans</klass> <subklass>2,6-dimethyl-3-benzazocines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0275076</sync-id> <structure-inchikey>MEIRVPWPDUXAER-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000000000000100000000000010000000000000000000000000400000040000400000000000000000000000000000000000000000000000008000000000800000000a000000000000000000000400000000000002100400080000000001000000000000201000200000000000000091208000000480000100000000000000040002000000000000000000800000000200000000c4000000000000000080000000000000000000000008000000000000000000000000800002020000000000000000000400000000000000200000000000000000000000000200040080000000000000000000000080000000002000200</structure-fingerprint> <structure-pattern-fingerprint>701642008512825081484b74812830201200140291052000003560628224484ccc2200501b8000000140590a00c08240056043a5608d320100a6647b04a04110c7118c881280160040901550006602400804858151211f3242041566402251040c2805271048a20440048404fdb40009208680d08501e00431182e5002510302104400094ef8820808060240892c0208391d8e124400168240ab0ca020c0048008d310103193d90302020968017c25104ac00422a943084010a042180cc00213a01000a40498003303808600145102802c11a000224450000d0122802a010300911068108881400008408403519aa0801c1002309042042e0100104052800a02</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`������@(������@(������� ������`�������`������� ������`�������`�������`������� ������`�������`�������`������� ������`������@h�������@(������@h�������@h��������h���������������������h����������� � � ������ � ����������������h���h���h���h��� ��� ����h����B���������������� �� ����������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:28:35Z</structure-indexed-at> </compound>