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CHEBI:225797 - Pseudoverticin

ChEBI IDCHEBI:225797
ChEBI NamePseudoverticin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H46N2O10
Net Charge0
Average Mass618.724
Monoisotopic Mass618.31525
SMILESCO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC3(C(C)(C)O)OCOC3=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
InChIInChI=1S/C32H46N2O10/c1-17-12-21-26(36)22(15-32(31(5,6)39)28(21)42-16-43-32)34-29(37)18(2)10-9-11-23(40-7)27(44-30(33)38)20(4)14-19(3)25(35)24(13-17)41-8/h9-11,14-15,17,19,23-25,27,35,39H,12-13,16H2,1-8H3,(H2,33,38)(H,34,37)/b11-9-,18-10+,20-14+/t17-,19+,23+,24+,25-,27+,32?/m1/s1
InChIKeyYKDKEARSLSHDPX-HDKYRRCQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1016/j.tetlet.2007.05.052)
ChEBI Ontology
Outgoing Relation(s)
Pseudoverticin (CHEBI:225797) is a dioxolane (CHEBI:39430)
IUPAC Name 
[(4E,6Z,8S,9S,10E,12S,13R,14S,16R)-13-hydroxy-23-(2-hydroxypropan-2-yl)-8,14-dimethoxy-4,10,12,16-tetramethyl-3,25-dioxo-20,22-dioxa-2-azatricyclo[16.6.1.019,23]pentacosa-1(24),4,6,10,18-pentaen-9-yl] carbamate
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