Byssochlamic acid

  • Formula: C18H20O6

  • Molecular weight: 332.30

  • Smiles: CCCC1CC2=C(CC(CC3=C1C(=O)OC3=O)CC)C(=O)OC2=O

Download

Byssochlamic acid

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
Fungi

Names

  • Mycotoxin name: Byssochlamic acid

  • First synonym: Byssochlamic acid

  • Synonyms: Byssochlamic acid, 743-51-1, LSM-2963, (+)-Byssoclamic acid, Spectrum_000288, SpecPlus_000589, Spectrum2_001829, Spectrum3_001705, Spectrum4_001852, Spectrum5_000384, BSPBio_003290, KBioGR_002285, KBioSS_000768, DivK1c_006685, SPBio_001877, CHEMBL3039421, CHEBI:92764, KBio1_001629, KBio2_000768, KBio2_003336, KBio2_005904, KBio3_002510, DTXSID80225315, CCG-38459, SDCCGMLS-0066921.P001, NCGC00178159-01, "1H-Cyclonona[1,2-c:5,6-c]difuran-1,3,6,8(4H)-tetrone,10-ethyl-5,9,10,11-tetrahydro-4-propyl-, (4S,10R)-", BRD-K43468059-001-02-9, Q27164526, (2S,10R)-10-ethyl-2-propyl-6,14-dioxatricyclo[10.3.0.04,8]pentadeca-1(12),4(8)-diene-5,7,13,15-tetrone, "1H-Cyclonona(1,2-c:5,6-c)difuran-1,3,6,8(4H)-tetrone, 10-ethyl-5,9,10,11-tetrahydro-4-propyl-, (4S-(4R*,10S*))-"

Identifiers / External links

Structure

  • Smiles: CCCC1CC2=C(CC(CC3=C1C(=O)OC3=O)CC)C(=O)OC2=O

  • Isomeric smiles: CCC[C@H]1CC2=C(C[C@H](CC3=C1C(=O)OC3=O)CC)C(=O)OC2=O

  • Inchi: InChI=1S/C18H20O6/c1-3-5-10-8-12-11(15(19)23-16(12)20)6-9(4-2)7-13-14(10)18(22)24-17(13)21/h9-10H,3-8H2,1-2H3/t9-,10+/m1/s1

  • Inchikey: NRDWUPPIGBHWAS-ZJUUUORDSA-N

  • 2D structure:

  • 3D structure:

UV spectrometer properties

  • Retention time: 21.23

  • Retention index: 1183

  • Peak symmetry: 1.40

  • UV absorption: 204(100), 352(58)

  • Predominant sensibility factor: 350, 371(58), 396(22)

  • Relative sensibility factor: 0.03000

Physico-chemical properties

  • Formula: C18H20O6

  • Molecular weight: 332.30

  • Monoisotopic mass: 332.12598835

Select an endpoint:

Select an endpoint:

Select an endpoint:

Select an endpoint:

Fungi