CHEBI:66042 - 1-hydroxycrisamicin A

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ChEBI Name 1-hydroxycrisamicin A
ChEBI ID CHEBI:66042
Definition An organic heterotetracyclic compound isolated from the culture broth of Micromonospora sp. SA-246. It exhibits potent antibacterial activity against several Gram-positive bacterial strains.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C32H22O13
Net Charge 0
Average Mass 614.50930
Monoisotopic Mass 614.10604
InChI InChI=1S/C32H22O13/c1-9-20-23(30-16(42-9)7-18(35)43-30)28(39)21-12(26(20)37)3-10(5-14(21)33)11-4-13-22(15(34)6-11)29(40)24-25(27(13)38)32(2,41)45-17-8-19(36)44-31(17)24/h3-6,9,16-17,30-31,33-34,41H,7-8H2,1-2H3/t9-,16-,17-,30+,31+,32-/m0/s1
InChIKey RGOCVNGEBMGCNA-WIDQCZIUSA-N
SMILES [H][C@]12CC(=O)O[C@@]1([H])C1=C([C@H](C)O2)C(=O)c2cc(cc(O)c2C1=O)-c1cc(O)c2C(=O)C3=C(C(=O)c2c1)[C@@](C)(O)O[C@@]1([H])CC(=O)O[C@@]31[H]
Metabolite of Species Details
Micromonospora (NCBI:txid1873) of strain SA 246 See: PubMed
Roles Classification
Biological Role(s): antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing 1-hydroxycrisamicin A (CHEBI:66042) has role antibacterial agent (CHEBI:33282)
1-hydroxycrisamicin A (CHEBI:66042) has role metabolite (CHEBI:25212)
1-hydroxycrisamicin A (CHEBI:66042) is a γ-lactone (CHEBI:37581)
1-hydroxycrisamicin A (CHEBI:66042) is a p-quinones (CHEBI:25830)
1-hydroxycrisamicin A (CHEBI:66042) is a cyclic ether (CHEBI:37407)
1-hydroxycrisamicin A (CHEBI:66042) is a organic heterotetracyclic compound (CHEBI:38163)
1-hydroxycrisamicin A (CHEBI:66042) is a organic hydroxy compound (CHEBI:33822)
IUPAC Name
(3aS,3a'S,5S,5'S,11bS,11b'S)-5,10,10'-trihydroxy-5,5'-dimethyl-3,3',3a,3a',5,5',11b,11b'-octahydro-2H,2'H-8,8'-bibenzo[g]furo[3,2-c]isochromene-2,2',6,6',11,11'-hexone
Registry Number Type Source
8180397 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
9531992 PubMed citation Europe PMC
Last Modified
03 June 2016