CHEBI:221341 - Emerimicin VII

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Emerimicin VII
ChEBI ID CHEBI:221341
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C75H124N16O19
Net Charge 0
Average Mass 1553.910
Monoisotopic Mass 1552.92287
InChI InChI=1S/C75H124N16O19/c1-22-73(19,89-63(106)71(15,16)87-62(105)70(13,14)86-61(104)69(11,12)82-56(99)49(32-41(4)5)78-43(8)93)64(107)77-37-54(97)80-50(33-42(6)7)57(100)84-74(20,23-2)65(108)88-72(17,18)66(109)90-38-46(94)35-51(90)58(101)81-48(30-31-53(76)96)55(98)85-75(21,24-3)67(110)91-39-47(95)36-52(91)59(102)83-68(9,10)60(103)79-45(40-92)34-44-28-26-25-27-29-44/h25-29,41-42,45-52,92,94-95H,22-24,30-40H2,1-21H3,(H2,76,96)(H,77,107)(H,78,93)(H,79,103)(H,80,97)(H,81,101)(H,82,99)(H,83,102)(H,84,100)(H,85,98)(H,86,104)(H,87,105)(H,88,108)(H,89,106)/t45-,46+,47+,48?,49-,50-,51-,52-,73+,74+,75+/m0/s1
InChIKey XNZNCJQPJKHTPR-TYIXHQEYSA-N
SMILES O=C(N1[C@H](C(=O)NC(C(=O)N[C@H](CO)CC2=CC=CC=C2)(C)C)C[C@H](C1)O)[C@](NC(=O)C(NC(=O)[C@H]3N(C(=O)C(NC(=O)[C@](NC(=O)[C@@H](NC(=O)CNC(=O)[C@](NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)[C@@H](NC(=O)C)CC(C)C)(C)C)(C)C)(C)C)(CC)C)CC(C)C)(CC)C)(C)C)C[C@@H](C3)O)CCC(=O)N)(CC)C
Metabolite of Species Details
Acremonium (NCBI:txid159075) 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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Emerimicin VII (CHEBI:221341) is a oligopeptide (CHEBI:25676)