CHEBI:216328 - Depsidomycin C

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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 Depsidomycin C
ChEBI ID CHEBI:216328
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C37H63N9O9
Net Charge 0
Average Mass 777.965
Monoisotopic Mass 777.47487
InChI InChI=1S/C37H63N9O9/c1-19(2)16-24-31(48)43-29(22(7)8)36(53)45-26(12-10-14-39-45)32(49)42-25(17-20(3)4)35(52)46-27(13-11-15-40-46)37(54)55-23(9)30(34(51)41-24)44-33(50)28(21(5)6)38-18-47/h18-30,39-40H,10-17H2,1-9H3,(H,38,47)(H,41,51)(H,42,49)(H,43,48)(H,44,50)/t23-,24+,25+,26-,27-,28+,29+,30+/m0/s1
InChIKey FEHACNSPRZIUGG-MIRUYOEFSA-N
SMILES O=C1N2NCCC[C@H]2C(=O)N[C@@H](C(=O)N3NCCC[C@H]3C(=O)O[C@H]([C@H](C(N[C@@H](C(N[C@@H]1C(C)C)=O)CC(C)C)=O)NC(=O)[C@H](NC=O)C(C)C)C)CC(C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) 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 Depsidomycin C (CHEBI:216328) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name
(2R)-2-ormamido-3-methyl-N-[(3R,6S,13R,16R,19R,20S,23S)-20-methyl-3,16-bis(2-methylpropyl)-2,5,12,15,18,22-hexaoxo-13-propan-2-yl-21-oxa-1,4,10,11,14,17,27-heptazatricyclo[21.4.0.06,11]heptacosan-19-yl]butanamide