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CHEBI:217185 - Ulongamide C

ChEBI IDCHEBI:217185
ChEBI NameUlongamide C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC36H45N5O7S
Net Charge0
Average Mass691.851
Monoisotopic Mass691.30397
SMILESCCC[C@H]1NC(=O)c2csc(n2)[C@H](C)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)C(Cc2ccc(O)cc2)N(C)C(=O)[C@H](C)OC(=O)[C@@H]1C
InChIInChI=1S/C36H45N5O7S/c1-7-11-27-21(2)36(47)48-23(4)34(45)41(6)30(19-25-14-16-26(42)17-15-25)35(46)40(5)29(18-24-12-9-8-10-13-24)32(44)37-22(3)33-39-28(20-49-33)31(43)38-27/h8-10,12-17,20-23,27,29-30,42H,7,11,18-19H2,1-6H3,(H,37,44)(H,38,43)/t21-,22+,23+,27-,29+,30?/m1/s1
InChIKeyPETFICLABWDIHU-OVYCRQNXSA-N
Species of MetaboliteComponentSourceComments
Lyngbya (ncbitaxon:28073) - PubMed (12141859)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Ulongamide C (CHEBI:217185) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(2S,5S,11S,14R,15R)-5-benzyl-8-[(4-hydroxyphenyl)methyl]-2,6,9,11,14-pentamethyl-15-propyl-12-oxa-20-thia-3,6,9,16,21-pentazabicyclo[16.2.1]henicosa-1(21),18-diene-4,7,10,13,17-pentone
Manual XrefsDatabases
78439859ChemSpider