CHEBI:84380 - chondramide A

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ChEBI Name chondramide A
ChEBI ID CHEBI:84380
Definition A chondramide that is chondramide C in which the pro-S hydrogen at position 2 of the β-tyrosine residue is replaced by a methoxy group. It is produced by strains of the myxobacterium, Chondromyces crocatus.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C36H46N4O7
Net Charge 0
Average Mass 646.77300
Monoisotopic Mass 646.33665
InChI InChI=1S/C36H46N4O7/c1-20-16-21(2)24(5)47-36(45)32(46-7)31(25-12-14-27(41)15-13-25)39-34(43)30(18-26-19-37-29-11-9-8-10-28(26)29)40(6)35(44)23(4)38-33(42)22(3)17-20/h8-16,19,21-24,30-32,37,41H,17-18H2,1-7H3,(H,38,42)(H,39,43)/b20-16+/t21-,22+,23+,24-,30-,31+,32+/m1/s1
InChIKey IEKCRWAFVYJECW-XYDQKOHOSA-N
SMILES CO[C@H]1[C@@H](NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](C)NC(=O)[C@@H](C)C\C(C)=C\[C@@H](C)[C@@H](C)OC1=O)c1ccc(O)cc1
Metabolite of Species Details
Chondromyces crocatus (NCBI:txid52) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
(via chondramide )
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing chondramide A (CHEBI:84380) has role antineoplastic agent (CHEBI:35610)
chondramide A (CHEBI:84380) has role bacterial metabolite (CHEBI:76969)
chondramide A (CHEBI:84380) is a chondramide (CHEBI:84384)
chondramide A (CHEBI:84380) is a indoles (CHEBI:24828)
chondramide A (CHEBI:84380) is a phenols (CHEBI:33853)
Incoming chondramide B (CHEBI:84381) has functional parent chondramide A (CHEBI:84380)
IUPAC Name
(3S,4S,7R,10S,13S,15E,17R,18R)-4-(4-hydroxyphenyl)-7-(1H-indol-3-ylmethyl)-3-methoxy-8,10,13,15,17,18-hexamethyl-1-oxa-5,8,11-triazacyclooctadec-15-ene-2,6,9,12-tetrone
Registry Number Type Source
22176305 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11722228 PubMed citation Europe PMC
20222097 PubMed citation Europe PMC
8557566 PubMed citation Europe PMC
Last Modified
20 January 2015