CHEBI:210468 - Versicotide B

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Versicotide B
ChEBI ID CHEBI:210468
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H29N5O5
Net Charge 0
Average Mass 479.537
Monoisotopic Mass 479.21687
InChI InChI=1S/C25H29N5O5/c1-14-21(31)27-20-13-9-7-11-18(20)25(35)30(5)16(3)24(34)29(4)15(2)22(32)28-19-12-8-6-10-17(19)23(33)26-14/h6-16H,1-5H3,(H,26,33)(H,27,31)(H,28,32)/t14-,15-,16-/m0/s1
InChIKey LBRVMRVQZVQIGN-JYJNAYRXSA-N
SMILES O=C1N([C@H](C(=O)N([C@H](C(=O)NC=2C=CC=CC2C(N[C@H](C(NC3=C1C=CC=C3)=O)C)=O)C)C)C)C
Metabolite of Species Details
Aspergillus versicolor (NCBI:txid46472) See: DOI
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Versicotide B (CHEBI:210468) is a dipeptide (CHEBI:46761)
IUPAC Name
(4S,15S,18S)-4,15,16,18,19-pentamethyl-2,5,13,16,19-pentazatricyclo[19.4.0.07,12]pentacosa-1(25),7,9,11,21,23-hexaene-3,6,14,17,20-pentone
Manual Xref Database
28185129 ChemSpider
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