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(Q77511529)
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English
Benastatin A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
500.5403
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₂₈O₇
0 references
canonical SMILES
CCCCCC1=C(C(=C2C(=C1)C=CC3=C(C4=C(C=C32)C(C5=C(C4=O)C(=CC(=C5)O)O)(C)C)O)O)C(=O)O
0 references
found in taxon
Streptomyces
3 references
stated in
Benastatins A and B, new inhibitors of glutathione S-transferase, produced by Streptomyces sp. MI384-DF12. I. Taxonomy, production, isolation, physico-chemical properties and biological activities.
stated in
Biosynthesis of benastatin A
stated in
Benastatins C and D, new inhibitors of glutathione S-transferase, produced by Streptomyces sp. MI384-DF12. Production, isolation, structure determination and biological activities
Identifiers
InChI
InChI=1S/C30H28O7/c1-4-5-6-7-14-10-15-8-9-17-18(22(15)27(34)23(14)29(36)37)13-20-25(26(17)33)28(35)24-19(30(20,2)3)11-16(31)12-21(24)32/h8-13,31-34H,4-7H2,1-3H3,(H,36,37)
0 references
InChIKey
LKGKHTANQJZVPR-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
126408
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
126408
language of work or name
English
CAS Registry Number
138968-85-1
0 references
PubChem CID
126408
1 reference
stated in
PubChem
PubChem CID
126408
language of work or name
English
UniChem compound ID
32033432
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30160848
0 references
DSSTOX compound identifier
DTXCID0083339
0 references
KNApSAcK ID
C00016744
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LKGKHTANQJZVPR-UHFFFAOYSA-N
Natural Product Atlas ID
NPA012843
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LKGKHTANQJZVPR-UHFFFAOYSA-N
Probes And Drugs ID
PD150870
0 references
LIPID MAPS ID
LMPK13050007
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
31 December 2022
InChIKey
LKGKHTANQJZVPR-UHFFFAOYSA-N
based on heuristic
InChIKey match
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