Molecule

Chaetoglobosin Fex

AlkaPlorer ID: AK079930

Synonym: None

IUPAC Name: (1S,5S,7Z,9S,11Z,14S,16S,17R,18S)-5,14-dihydroxy-18-(1H-indol-3-ylmethyl)-7,9,16-trimethyl-15-methylidene-19-azatricyclo[11.7.0.01,17]icosa-7,11-diene-2,6,20-trione

Structure

SMILES: C=C1[C@@H](O)C2/C=C\C[C@H](C)/C=C(/C)C(=O)[C@@H](O)CCC(=O)[C@@]23C(=O)N[C@@H](CC2=CNC4=CC=CC=C24)[C@@H]3[C@@H]1C

InChI: InChI=1S/C32H38N2O5/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/h5-7,9-11,14,16-17,19,23,25-26,28,30,33,35,38H,4,8,12-13,15H2,1-3H3,(H,34,39)/b10-7-,18-14-/t17-,19+,23?,25-,26-,28-,30+,32-/m0/s1

InChIKey: UFMHUKPYQLJSOB-WELTXKSQSA-N

Reference

20-Ketoreductase Activity of Chaetoglobosin A and Prochaetoglobosins in a Cell-free System of<i>Chaetomium subaffine</i>and the Isolation of New Chaetoglobosins

PubChem CID: 139585127

LOTUS: LTS0090483

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NPAtlas: NPA007236

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Chaetomium subaffine	Chaetomium	Chaetomiaceae	Sordariales	Sordariomycetes	Ascomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 530.6650000000002

TPSA？: 119.48999999999998

MolLogP？: 3.8160000000000016

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi