CHEBI:201086 - Grincamycin F

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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 Grincamycin F
ChEBI ID CHEBI:201086
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000004097885
Download Molfile XML SDF
Formula C57H66O20
Net Charge 0
Average Mass 1071.135
Monoisotopic Mass 1070.41474
InChI InChI=1S/C57H66O20/c1-25-35(59)11-15-42(69-25)73-37-13-17-44(71-27(37)3)75-40-22-39(68-29(5)50(40)62)33-21-34-46(30-7-9-31(58)10-8-30)54(65)76-53-47(34)48(52(33)64)51(63)32-19-20-56(66)24-55(6,23-41(61)57(56,67)49(32)53)77-45-18-14-38(28(4)72-45)74-43-16-12-36(60)26(2)70-43/h7-10,19-21,25-29,37-40,42-45,50,58,62-63,66-67H,11-18,22-24H2,1-6H3/t25?,26?,27?,28?,29?,37?,38?,39?,40?,42?,43?,44?,45?,50?,55-,56-,57-/m0/s1
InChIKey IYLDGTNOLQRGOZ-ZNVFNITESA-N
SMILES O=C1OC2=C3C(C(=O)C(=CC3=C1C4=CC=C(O)C=C4)C5OC(C(O)C(C5)OC6OC(C(OC7OC(C(=O)CC7)C)CC6)C)C)=C(O)C8=C2[C@@]9(O)C(=O)C[C@@](OC%10OC(C(OC%11OC(C(=O)CC%11)C)CC%10)C)(C)C[C@@]9(O)C=C8
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Grincamycin F (CHEBI:201086) is a organic heterotricyclic compound (CHEBI:26979)
Grincamycin F (CHEBI:201086) is a organooxygen compound (CHEBI:36963)