CHEBI | Classes | NFDI4Biodiversity BiodivPortal

ID	http://purl.obolibrary.org/obo/CHEBI_66117 http://purl.obolibrary.org/obo/CHEBI_66117 https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_66117 Loading
Preferred name	jaspamide O
Synonyms	(4R,7R,10S,13S,15E,17R,19S)-7-[2-(2-aminophenyl)-2-oxoethyl]-4-(4-hydroxyphenyl)-8,10,13,15,17,19-hexamethyl-1-oxa-5,8,11-triazacyclononadec-15-ene-2,6,9,12-tetrone
Definitions	A cyclodepsipeptide isolated from Jaspis splendens. A derivative of jaspamide, it has been shown to exhibit cytotoxic and microfilament disruption activity.

oboinowl_gen:inSubset	http://purl.obolibrary.org/obo/chebi#3_STAR
obo_purl:smiles	C[C@H]1C[C@@H](C)C=C(C)\C[C@H](C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](CC(=O)c2ccccc2N)C(=O)N[C@H](CC(=O)O1)c1ccc(O)cc1
obo_purl:charge	0
obo_purl:inchikey	BPHLRINTBGJQFP-BEZABZTFSA-N
obo_purl:RO_0000087	http://purl.obolibrary.org/obo/CHEBI_70728 http://purl.obolibrary.org/obo/CHEBI_35610 http://purl.obolibrary.org/obo/CHEBI_25212
oboinowl_gen:hasDbXref	Reaxys:18837685
obo_purl:IAO_0000115	A cyclodepsipeptide isolated from Jaspis splendens. A derivative of jaspamide, it has been shown to exhibit cytotoxic and microfilament disruption activity.
skos:notation	CHEBI:66117
oboinowl_gen:hasExactSynonym	(4R,7R,10S,13S,15E,17R,19S)-7-[2-(2-aminophenyl)-2-oxoethyl]-4-(4-hydroxyphenyl)-8,10,13,15,17,19-hexamethyl-1-oxa-5,8,11-triazacyclononadec-15-ene-2,6,9,12-tetrone
obo_purl:mass	634.76230
obo_purl:inchi	InChI=1S/C35H46N4O7/c1-20-15-21(2)17-23(4)46-32(42)18-29(25-11-13-26(40)14-12-25)38-34(44)30(19-31(41)27-9-7-8-10-28(27)36)39(6)35(45)24(5)37-33(43)22(3)16-20/h7-15,21-24,29-30,40H,16-19,36H2,1-6H3,(H,37,43)(H,38,44)/b20-15+/t21-,22-,23-,24-,29+,30+/m0/s1
obo_purl:formula	C35H46N4O7
oboinowl_gen:hasOBONamespace	chebi_ontology
rdf:type	http://www.w3.org/2002/07/owl#Class
oboinowl_gen:id	CHEBI:66117
rdfs:label	jaspamide O
obo_purl:monoisotopicmass	634.33665
rdfs:subClassOf	http://purl.obolibrary.org/obo/CHEBI_48975 http://purl.obolibrary.org/obo/CHEBI_51026 http://purl.obolibrary.org/obo/CHEBI_35213

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