Toxiferine I, 2,2′,16,16′-tetradehydro-16,16′,17,17′-tetrahydro-
CAS Registry Number®
302-30-7
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CAS Name
Toxiferine I, 2,2′,16,16′-tetradehydro-16,16′,17,17′-tetrahydro-Molecular Formula
C40H46N4O2Cite this Page
Toxiferine I, 2,2′,16,16′-tetradehydro-16,16′,17,17′-tetrahydro-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=302-30-7 (retrieved ) (CAS RN: 302-30-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C40H46N4O2/c1-43-15-13-39-31-7-3-5-9-33(31)41-22-30-28-20-36-40(14-16-44(36,2)24-26(28)12-18-46)32-8-4-6-10-34(32)42(38(30)40)21-29(37(39)41)27(19-35(39)43)25(23-43)11-17-45/h3-12,27-28,35-36,45-46H,13-24H2,1-2H3/q+2
InChIKey
InChIKey=RZIAOXYHSNCEEJ-UHFFFAOYSA-N
SMILES
C[N+]12C3C4(C5=C(C(C3)C(=CCO)C1)CN6C7=C(CN5C=8C4=CC=CC8)C9CC%10C7(C=%11C6=CC=CC%11)CC[N+]%10(C)CC9=CCO)CC2
Canonical SMILES
OCC=C1C[N+]2(C)CCC34C=5C=CC=CC5N6C4=C(CN7C=8C=CC=CC8C9%10C7=C(C6)C%11C(=CCO)C[N+](C)(CC9)C%10C%11)C1CC32
Other Names for this Substance
- Toxiferine I, 2,2′,16,16′-tetradehydro-16,16′,17,17′-tetrahydro-
- Toxiferine
- 10H,21H-1,21:10,12-Diethano-19aH,20bH-dipyrrolo[3,2-f:3′,2′-f′][1,5]diazocino[3,2,1-jk:7,6,5-j'k′]dicarbazole, toxiferine I deriv.
- MeSH ID: D014117
