CHEBI:70589 - Scytonemide A

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ChEBI Name Scytonemide A
ChEBI ID CHEBI:70589
Definition A natural product found in Scytonema hofmanni.
Stars This entity has been manually annotated by a third party.
Supplier Information No supplier information found for this compound.
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Formula C36H56N8O9
Net Charge 0
Average Mass 744.87800
Monoisotopic Mass 744.41703
InChI InChI=1S/C36H56N8O9/c1-7-21(6)31-36(53)42-27(18-45)34(51)43-30(20(4)5)35(52)40-23(14-19(2)3)16-38-26(15-22-8-10-24(46)11-9-22)32(49)39-17-29(48)41-25(33(50)44-31)12-13-28(37)47/h8-11,16,19-21,23,25-27,30-31,45-46H,7,12-15,17-18H2,1-6H3,(H2,37,47)(H,39,49)(H,40,52)(H,41,48)(H,42,53)(H,43,51)(H,44,50)/b38-16-/t21-,23-,25+,26-,27-,30-,31-/m0/s1
InChIKey HJKXQQVDTIEFDD-FAVUQDIBSA-N
SMILES [H][C@]1(NC(=O)[C@@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)\N=C/[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC1=O)C(C)C)[C@@H](C)CC
Metabolite of Species Details
Scytonema hofmanni (NCBI:txid34078) Lyophilized cell material of freshwater cyanobacterium was extracted with MeOH-CH2Cl2 (1:1) of strain UTEX 1834 See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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 Scytonemide A (CHEBI:70589) has role metabolite (CHEBI:25212)
Scytonemide A (CHEBI:70589) is a cyclic peptide (CHEBI:23449)
Manual Xref Database
27022797 ChemSpider
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Citation Waiting for Citations
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:keratan 6'-sulfate(CHEBI:18331); ISA:azamacrocycle(CHEBI:52898); ISA:aralkylamine(CHEBI:18000); ISA:phenols(CHEBI:33853); ISA:fatty amide(CHEBI:29348); ISA:amino alcohol(CHEBI:22478); ISA:carboxamide(CHEBI:37622); ISA:polyol(CHEBI:26191); ISA:lactam(CHEBI:24995); ISA:carboxylic acid(CHEBI:33575); ISA:dipolar compound(CHEBI:51151); ISA:aromatic alcohol(CHEBI:33854); ISA:carbonyl compound(CHEBI:36586); ISA:primary alcohol(CHEBI:15734);