Ulongamide D (CHEBI:203071)

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CHEBI:203071 - Ulongamide D

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ChEBI ID	CHEBI:203071
ChEBI Name	Ulongamide D
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C34H49N5O7S
Net Charge	0
Average Mass	671.861
Monoisotopic Mass	671.33527
SMILES	CCC[C@H]1NC(=O)c2csc(n2)[C@H](C)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)[C@H](C(C)C)OC(=O)[C@H]1C
InChI	InChI=1S/C34H49N5O7S/c1-10-11-24-20(6)34(45)46-28(19(4)5)33(44)38(8)26(16-22-12-14-23(40)15-13-22)32(43)39(9)27(18(2)3)30(42)35-21(7)31-37-25(17-47-31)29(41)36-24/h12-15,17-21,24,26-28,40H,10-11,16H2,1-9H3,(H,35,42)(H,36,41)/t20-,21-,24+,26-,27-,28-/m0/s1
InChIKey	FRWFEXMWAJIROC-FEHSMJKKSA-N

Species of Metabolite	Component	Source	Comments
Lyngbya (ncbitaxon:28073)	-	PubMed (12141859)

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	Ulongamide D (CHEBI:203071) is a cyclodepsipeptide (CHEBI:35213)

IUPAC Name
(2S,5S,8S,11S,14S,15R)-8-[(4-hydroxyphenyl)methyl]-2,6,9,14-tetramethyl-5,11-di(propan-2-yl)-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 Xrefs	Databases
9127714	ChemSpider