Basic information
- CAS
66513-28-8- Standard SMILES
CC/C(=C\C=C\[C@H]1C=C[C@@H]2[C@@H](CC)CC[C@H]2[C@@H]1C(=O)c1ccc[nH]1)[C@@H]1OC([C@@H](C)C(=O)O)CC[C@@H]1C- InChIKey
BAIPOTOKPGDCHA-DFPVWRGBSA-N- Molecular formula
- C31H43NO4
- Average molar mass
- 493.7 g/mol
- Monoisotopic mass
- 493.31920885
Overview
Antibiotic X 14547A has been reported in Streptomyces griseofuscus with data available.
Names & identifiers
- Preferred name
- Antibiotic X 14547A
- IUPAC
- (2R)-2-[(5S,6R)-6-[(3E,5E)-6-[(1S,3aR,4S,5R,7aS)-1-ethyl-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl]hexa-3,5-dien-3-yl]-5-methyloxan-2-yl]propanoic acid
- English name
- INDANOMYCIN FROM STREPTOMYCES*ANTIBIOTIC US
- Molecular formula
- C31H43NO4
- Molecular weight
- 493.684
Names & synonyms
Antibiotic X 14547A(2R)-2-[(5S,6R)-6-[(3E,5E)-6-[(1S,3aR,4S,5R,7aS)-1-ethyl-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl]hexa-3,5-dien-3-yl]-5-methyloxan-2-yl]propanoic acid(2R)-2-((5S,6R)-6-((3E,5E)-6-((1S,3aR,4S,5R,7aS)-1-ethyl-4-(1H-pyrrole-2-carbonyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-5-yl)hexa-3,5-dien-3-yl)-5-methyloxan-2-yl)propanoic acidRefChem:1077092IndamycinAntibiotic X 1454766513-28-8X 14547AX 145472H-Pyran-2-acetic acid, 6-(1-ethyl-4-(1-ethyl-2,3,3a,4,5,7a-hexahydro-4-(1H-pyrrol-2-ylcarbonyl)-1H-inden-5-yl)-1,3-butadienyl)tetrahydro-alpha,5-dimethyl-, (1S-(1-alpha,3-alpha,beta,4-beta,5-beta(1E(2S*(S*),5R*,6S*),3E),7a-alpha))-SCHEMBL31329252X-14547-A
Show more names
x14547x14547aantibioticx14547antibioticx14547aINDANOMYCIN FROM STREPTOMYCES*ANTIBIOTIC US5-dimethyl-rol-2-ylcarbonyl)-1h-inden-5-yl)-3-butadienyl)tetrahydro-alpha3-alpha,beta,4-beta,5-beta(1e(2s*(s*),5r*,6s*),3e),7a-alpha))-(1s-(1-alph
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 876
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- solubility
- DMF: soluble; DMSO: soluble; Ethanol: soluble; Methanol: soluble
- form
- A solid
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H311-H331
- Precautionary statements
- 261 · P261-P280-P301+P310-P311
- Hazard Codes
- T
- Risk Statements
- 23 · 23/24/25
- Safety Statements
- 36 · 36/37/39-45
- RIDADR
- 2811 · UN 2811 6.1 / PGIII
- RTECS
- 6100000 · UP6100000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- rtecs
- UP6100000
- ridadr
- UN 2811 6.1 / PGIII
- risk_code
- 23/24/25
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- T
- safety_code
- 36/37/39-45
- Hazard statements
- H301-H311-H331
- Precautionary statements
- P261-P280-P301+P310-P311
Chemistry & industry
Applications
DescriptionIndanomycin is an antibiotic of the pyrroloketoindane class, which includes an unusual indane ring structure. It has bactericidal activity against Gram-positive bacteria, with minimum inhibitory concentration (MIC) values of ≤0.2 μg/ml, and insecticidal activity.
UsesIndanomycin is an unusual pyrollic ionophore active against Gram positive bacteria and insects. Interestingly, indanomycin has antihypertensive properties. Indanomycin possesses affinity for both mono- and divalent ions, and has been reported as a growth promotor in ruminants.
UsesIndanomycin is an unusual pyrollic ionophore active against Gram +ve bacteria and insects.
Suppliers15 total
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
西安莱茵生物科技有限公司86-(0)29-85992781 17792393971 · [email protected]
Novachemistry44-20819178-90 02081917890 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
TargetMol中国（陶术生物）
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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