CHEBI:68778 - chaetoglobosin Vb

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name chaetoglobosin Vb
ChEBI ID CHEBI:68778
Definition A cytochalasan alkaloid found in Chaetomium globosum.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C32H36N2O5
Net Charge 0
Average Mass 528.63860
Monoisotopic Mass 528.26242
InChI InChI=1S/C32H36N2O5/c1-15-8-7-10-22-28(36)17(3)16(2)27-24(12-19-14-33-23-11-6-5-9-20(19)23)34-31(39)32(22,27)25(35)13-21-26(15)18(4)29(37)30(21)38/h5-7,9-11,14-15,21-22,24,26-28,33,36-37H,8,12-13H2,1-4H3,(H,34,39)/b10-7+/t15-,21+,22-,24-,26-,27-,28+,32+/m0/s1
InChIKey PRTGSLLKDHOTJT-CIQYLYMDSA-N
SMILES C[C@H]1C\C=C\[C@H]2[C@H](O)C(C)=C(C)[C@H]3[C@H](Cc4c[nH]c5ccccc45)NC(=O)[C@@]23C(=O)C[C@@H]2[C@@H]1C(C)=C(O)C2=O
Metabolite of Species Details
Chaetomium globosum (NCBI:txid38033) See: PubMed
Roles Classification
Biological Role(s): Chaetomium metabolite
Any fungal metabolite produced during a metabolic reaction in the mould, Chaetomium.
fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
(via cytochalasan alkaloid )
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing chaetoglobosin Vb (CHEBI:68778) has role Chaetomium metabolite (CHEBI:76960)
chaetoglobosin Vb (CHEBI:68778) is a cytochalasan alkaloid (CHEBI:75946)
chaetoglobosin Vb (CHEBI:68778) is a indoles (CHEBI:24828)
chaetoglobosin Vb (CHEBI:68778) is a macrocycle (CHEBI:51026)
IUPAC Name
(3S,3aR,6S,6aR,7E,10S,10aR,13aR,15aR)-6,12-dihydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,11-tetramethyl-2,3,3a,6,6a,9,10,10a,13a,14-decahydro-1H-cyclopenta[7,8]cyclodeca[1,2-d]isoindole-1,13,15-trione
Registry Number Type Source
22911554 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22593034 PubMed citation Europe PMC
Last Modified
28 October 2013