CHEBI:221323 - Strevertene 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 Strevertene C
ChEBI ID CHEBI:221323
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C32H50O10
Net Charge 0
Average Mass 594.742
Monoisotopic Mass 594.34040
InChI InChI=1S/C32H50O10/c1-4-29-21(2)14-11-9-7-5-6-8-10-12-17-26(36)30(31(39)40)28(38)19-24(34)16-13-15-23(33)18-25(35)20-27(37)22(3)32(41)42-29/h5-12,14,17,21-30,33-38H,4,13,15-16,18-20H2,1-3H3,(H,39,40)/b6-5-,9-7-,10-8-,14-11-,17-12-/t21-,22+,23-,24+,25-,26+,27-,28+,29+,30-/m0/s1
InChIKey ALIOWXDCTBYGOF-YHESGONPSA-N
SMILES O=C1O[C@@H]([C@H](C=CC=CC=CC=CC=C[C@@H](O)[C@@H]([C@@H](C[C@@H](CCC[C@@H](C[C@@H](C[C@@H]([C@H]1C)O)O)O)O)O)C(=O)O)C)CC
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: DOI
ChEBI Ontology
Outgoing Strevertene C (CHEBI:221323) is a macrolide (CHEBI:25106)
IUPAC Name
(3R,4S,6S,8S,12R,14R,15R,16R,17Z,19Z,21Z,23Z,25Z,27S,28R)-28-ethyl-4,6,8,12,14,16-hexahydroxy-3,27-dimethyl-2-oxo-1-oxacyclooctacosa-17,19,21,23,25-pentaene-15-carboxylic acid