Chaetoglobosin b

Formula: C32H36N2O5
Molecular weight: 528.60
Smiles: CC1CC=CC2C(C(=C(C3C2(C(=O)C=CC(=O)C(C(=C1)C)O)C(=O)NC3CC4=CNC5=CC=CC=C54)C)C)O

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Chaetoglobosin b

Names

Structural Information

Physico-chemical Properties

ADME

Toxicity

Medical Chemistry

Fungi

Mycotoxin name: Chaetoglobosin b
First synonym: Chaetoglobosin b
Synonyms: chaetoglobosin B,50335-04-1,(1R,3E,6R,7Z,9S,11E,13R,14S,17R,18S)-6,14-Dihydroxy-18-(1H-indol-3-ylmethyl)-7,9,15,16-tetramethyl-19-azatricyclo[11.7.0.01,17]icosa-3,7,11,15-tetraene-2,5,20-trione,(13)Cytochalasa-5,13,17,21-tetraene-1,20,23-trione, 7,19-dihydroxy-10-(1H-indol-3-yl)-16,18-dimethyl-, (7S,13E,16S,17E,19R,21E)-,(7S,13E,16S,17E,19R,21E)-7,19-Dihydroxy-10-(1H-indol-3-yl)-16,18-dimethyl-(13)cytochalasa-5,13,17,21-tetraene-1,20,23-trione,1H-Cyclotridec(d)isoindole-1,14,17-trione, 2,3,3a,6,6a,9,10,13-octahydro-6,13-dihydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-, (3S,3aR,6S,6aR,7E,10S,11E,13R,17aR)-

Smiles: CC1CC=CC2C(C(=C(C3C2(C(=O)C=CC(=O)C(C(=C1)C)O)C(=O)NC3CC4=CNC5=CC=CC=C54)C)C)O
Isomeric smiles: C[C@H]\1C/C=C/[C@H]2[C@@H](C(=C([C@@H]3[C@@]2(C(=O)/C=C/C(=O)[C@@H](/C(=C1)/C)O)C(=O)N[C@H]3CC4=CNC5=CC=CC=C54)C)C)O
Inchi: InChI=1S/C32H36N2O5/c1-17-8-7-10-23-30(38)20(4)19(3)28-25(15-21-16-33-24-11-6-5-9-22(21)24)34-31(39)32(23,28)27(36)13-12-26(35)29(37)18(2)14-17/h5-7,9-14,16-17,23,25,28-30,33,37-38H,8,15H2,1-4H3,(H,34,39)/b10-7+,13-12+,18-14+/t17-,23-,25-,28-,29+,30+,32+/m0/s1
Inchikey: VUEFRYQBOMQOMV-MLXGBZTESA-N

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Fungi id	Species
349	Chaetomium subaffine