CHEBI:69600 - Pendolmycin

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ChEBI Name Pendolmycin
ChEBI ID CHEBI:69600
Definition A natural product found in Marinactinospora thermotolerans.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H31N3O2
Net Charge 0
Average Mass 369.50040
Monoisotopic Mass 369.24163
InChI InChI=1S/C22H31N3O2/c1-7-22(4,5)16-8-9-17-18-14(11-23-19(16)18)10-15(12-26)24-21(27)20(13(2)3)25(17)6/h7-9,11,13,15,20,23,26H,1,10,12H2,2-6H3,(H,24,27)/t15-,20-/m0/s1
InChIKey JPJWIAYMFHOJRY-YWZLYKJASA-N
SMILES CC(C)[C@@H]1N(C)c2ccc(c3[nH]cc(C[C@@H](CO)NC1=O)c23)C(C)(C)C=C
Metabolite of Species Details
Marinactinospora thermotolerans (NCBI:txid531310) Found in spore (BTO:0001171). Crude extract of fermented medium inoculated with spores and mycelia of strain SCSIO 00652 See: PubMed
Marinactinospora thermotolerans (NCBI:txid531310) Found in mycelium (BTO:0001436). Crude extract of fermented medium inoculated with spores and mycelia of strain SCSIO 00652 See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Pendolmycin (CHEBI:69600) has role metabolite (CHEBI:25212)
Pendolmycin (CHEBI:69600) is a indoles (CHEBI:24828)
Synonym Source
(2S,5S)-5-(Hydroxymethyl)-2-isopropyl-1-methyl-9-(2-methyl-3-buten-2-yl)-1,2,4,5,6,8-hexahydro-3H-[1,4]diazonino[7,6,5-cd]indol-3-one ChEBI
Registry Number Type Source
119375-01-8 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
21977916 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:dialkylarylamine(CHEBI:23665); ISA:tertiary amino compound(CHEBI:50996); ISA:aralkylamine(CHEBI:18000); ISA:benzenoid aromatic compound(CHEBI:33836); ISA:pyrroles(CHEBI:26455); ISA:lactam(CHEBI:24995); ISA:carboxamide(CHEBI:37622); ISA:carboxylic acid(CHEBI:33575); ISA:carbonyl compound(CHEBI:36586); ISA:primary alcohol(CHEBI:15734);