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FR901464

CAT: 0013-GTR19194519-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19194519-04Size:25 mg
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Description
FR901464
CAS Number
146478-72-0
Product Name Alternative
FR 901464, FR901464, FR-901464, WB 2663B
Purity
98.29% (May vary between batches)
Solubility
DMSO:90 mg/mL (177.3 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (6.5 mM)
Smiles
C[C@H] (OC (C) =O) \C=C/C (=O) N[C@@H]1C[C@H] (C) [C@H] (C\C=C (/C) \C=C\[C@H]2O[C@] (C) (O) C[C@@]3 (CO3) [C@@H]2O) O[C@@H]1C
Molecular Formula
C27H41NO8
Molecular Weight
507.62
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

FR901464

FR901464 is a spiro-epoxide with potent anticancer activity that lowers the mRNA levels of oncogenes and tumour supressor genes. It is isolated from Pseudomonas sp. no.2663. It has a role as an antimicrobial agent, an antineoplastic agent and a bacterial metabolite. It is a spiro-epoxide, a member of pyrans, a monocarboxylic acid amide, an acetate ester and a cyclic hemiketal.

CAS Number146478-72-0
PubChem CID10553647
IUPAC Name[(Z,2S)-5-[[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(3R,4R,5R,7S)-4,7-dihydroxy-7-methyl-1,6-dioxaspiro[2.5]octan-5-yl]-3-methylpenta-2,4-dienyl]-2,5-dimethyloxan-3-yl]amino]-5-oxopent-3-en-2-yl] acetate
Molecular FormulaC27H41NO8
Molecular Weight507.6
XLogP2
Topological Polar Surface Area127
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Heavy Atom Count36
Formal Charge0
Complexity900
SMILES
C[C@H]1C[C@H]([C@H](O[C@H]1C/C=C(\C)/C=C/[C@@H]2[C@H]([C@@]3(C[C@@](O2)(C)O)CO3)O)C)NC(=O)/C=C\[C@H](C)OC(=O)C
InChI
InChI=1S/C27H41NO8/c1-16(8-11-23-25(31)27(15-33-27)14-26(6,32)36-23)7-10-22-17(2)13-21(19(4)35-22)28-24(30)12-9-18(3)34-20(5)29/h7-9,11-12,17-19,21-23,25,31-32H,10,13-15H2,1-6H3,(H,28,30)/b11-8+,12-9-,16-7+/t17-,18-,19+,21+,22-,23+,25+,26-,27+/m0/s1
InChIKey
PJKVJJDQXZARCA-QHYZBLTGSA-N
Chemical Structure
2D Structure
2D structure of FR901464
CAS: 146478-72-0
CID: 10553647
Formula: C27H41NO8
MW: 507.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight507.6
XLogP32
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass507.28321727
Monoisotopic Mass507.28321727
Topological Polar Surface Area127 Ų
Heavy Atom Count36
Formal Charge0
Complexity900
Isotope Atom Count0
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count3
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
BUP01121-01FR901464
A12702-10FR901464 10mg
A12702-100FR901464 100mg
A12702-50FR901464 50mg
A12702-1FR901464 1mg
A12702-25FR901464 25mg
A12702-5FR901464 5mg

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