Cas no 58812-37-6 (Toosendanin)

Toosendanin is a bioactive triterpenoid compound primarily extracted from the bark or seeds of Melia toosendan, a plant belonging to the Meliaceae family. It exhibits notable insecticidal, anthelmintic, and neurotoxic properties, making it a subject of interest in agricultural and pharmacological research. Toosendanin acts as a selective blocker of neurotransmitter release, particularly at neuromuscular junctions, which contributes to its efficacy against certain pests and parasites. Its mechanism involves disrupting calcium ion channels, leading to paralysis in target organisms. The compound is also studied for potential anti-tumor and anti-inflammatory applications. Its natural origin and specific activity profile offer advantages in integrated pest management and biomedical research.
Toosendanin structure
Toosendanin structure
Product Name:Toosendanin
CAS No:58812-37-6
MF:C30H38O11
MW:574.61613035202
MDL:MFCD00210564
CID:57331
PubChem ID:9851101
Update Time:2025-12-17

Toosendanin Chemical and Physical Properties

Names and Identifiers

    • Toosendanin
    • 24-Norchola-20,22-diene-4-carboxaldehyde,3,12-bis(acetyloxy)-14,15:21,23-diepoxy-1,7,19-trihydroxy-4,8-dimethyl-11-oxo-,cyclic4,19-hemiacetal, [C(R),1α,3α,4β, 5α,7α,12α,13α,14β,15β,17α]-
    • Chuanliansu
    • 28-Deacetylsendanin
    • 12-AcetoxyaMoorastatin
    • Trichilinin
    • N1864
    • [(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16S,19R,21S)-4-Acetyloxy-6-(furan-3-yl)-12,16,19-trihydroxy-
    • Q-100679
    • MFCD00210564
    • CHEBI:192461
    • 58812-37-6
    • AS-56295
    • [(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-4-Acetyloxy-6-(furan-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate
    • CHEMBL503044
    • HY-N0263
    • AKOS025311566
    • CS-0008285
    • [(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-4-acetyloxy-6-(uran-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate
    • [(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15S,16R,19S,21R)-4-Acetyloxy-6-(furan-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate
    • SCHEMBL15942911
    • NS00067872
    • FT-0689315
    • B0005-464304
    • [(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-4-acetyloxy-6-(furan-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0^{1,14.0^{2,11.0^{5,10.0^{8,10]henicosan-21-yl] acetate
    • [4-Acetyloxy-6-(furan-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate
    • MDL: MFCD00210564
    • Inchi: 1S/C30H38O11/c1-13(31)39-20-10-19(34)29-12-38-25(36)26(20,3)17(29)9-18(33)28(5)23(29)22(35)24(40-14(2)32)27(4)16(15-6-7-37-11-15)8-21-30(27,28)41-21/h6-7,11,16-21,23-25,33-34,36H,8-10,12H2,1-5H3/t16-,17-,18+,19-,20+,21+,23-,24-,25+,26+,27+,28+,29+,30+/m0/s1
    • InChI Key: NAHTXVIXCMUDLF-RFNFAWMESA-N
    • SMILES: O1[C@@H]2C[C@@H](C3=COC=C3)[C@]3(C)[C@H](C([C@@H]4[C@@]56CO[C@H]([C@@](C)([C@@H](C[C@@H]5O)OC(C)=O)[C@@H]6C[C@H]([C@@]4(C)[C@]132)O)O)=O)OC(C)=O

Computed Properties

  • Exact Mass: 574.24100
  • Monoisotopic Mass: 574.24141202 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 11
  • Heavy Atom Count: 41
  • Rotatable Bond Count: 5
  • Complexity: 1190
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 12
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 574.6
  • XLogP3: 0.7
  • Topological Polar Surface Area: 165

Experimental Properties

  • Color/Form: Powder
  • Density: 1.2084 (rough estimate)
  • Melting Point: 244-245°C
  • Boiling Point: 714℃ at 760 mmHg
  • Refractive Index: 1.5970 (estimate)
  • PSA: 165.26000
  • LogP: 1.46610

Toosendanin Security Information

Toosendanin Customs Data

  • HS CODE:29389090

Toosendanin Pricemore >>

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Toosendanin Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:58812-37-6)Toosendanin
Order Number:LE10382;LE26658179
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:03
Price ($):discuss personally
Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:58812-37-6)Toosendanin
Order Number:sfd472
Stock Status:in Stock
Quantity:200kg
Purity:99%
Pricing Information Last Updated:Friday, 19 July 2024 14:32
Price ($):discuss personally

Toosendanin Spectrogram

1H NMR 300 MHz DMSO
1H NMR
13C NMR
13C NMR
Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:58812-37-6)Toosendanin
LE10382;LE26658179
Purity:99%/99%
Quantity:25KG,200KG,1000KG/25KG,200KG,1000KG
Price ($):Inquiry/Inquiry
Email
Suzhou Senfeida Chemical Co., Ltd
(CAS:58812-37-6)Toosendanin
sfd472
Purity:99%
Quantity:200kg
Price ($):Inquiry
Email