Destruxin F (CHEBI:203679)

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CHEBI:203679 - Destruxin F

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ChEBI ID	CHEBI:203679
ChEBI Name	Destruxin F
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C29H49N5O8
Net Charge	0
Average Mass	595.738
Monoisotopic Mass	595.35811
SMILES	CCC(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)C(CC(C)O)OC(=O)CCNC(=O)[C@H](C)N(C)C(=O)[C@H](C(C)C)N(C)C1=O
InChI	InChI=1S/C29H49N5O8/c1-9-17(4)23-28(40)33(8)24(16(2)3)29(41)32(7)19(6)25(37)30-13-12-22(36)42-21(15-18(5)35)27(39)34-14-10-11-20(34)26(38)31-23/h16-21,23-24,35H,9-15H2,1-8H3,(H,30,37)(H,31,38)/t17?,18?,19-,20-,21?,23-,24-/m0/s1
InChIKey	UOFIHDFDXCKQGS-CZYRZQCKSA-N

Species of Metabolite	Component	Source	Comments
Metarhizium anisopliae (ncbitaxon:5530)	-	DOI (10.1021/np50094a034)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Destruxin F (CHEBI:203679) is a cyclodepsipeptide (CHEBI:35213)

IUPAC Name
(10S,13S,16S,19S)-16-butan-2-yl-3-(2-hydroxypropyl)-10,11,14-trimethyl-13-propan-2-yl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone

Manual Xrefs	Databases
78445509	ChemSpider