Products for Research Use Only

Stigmatellin

CAT: 0013-GTR19237345-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19237345-02Size:50 mg
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Description
Stigmatellin is a natural antibiotic and potent inhibitor of photosynthetic electron transfer, effective against yeasts, fungi, and Gram-positive bacteria. It is widely used in research to study antimicrobial mechanisms, photosynthesis, and cellular processes in both in vitro and in vivo experimental models.
CAS Number
91682-96-1
Field of Research
Cell Biology, Infectious Disease & Virology, Molecular Biology
Smiles
O=C1C=2C (OC) =CC (OC) =C (O) C2OC (=C1C) CCC (C) C (OC) C (C) C (OC) C=CC=CC (=CC) C
Molecular Formula
C30H42O7
Molecular Weight
514.65
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Stigmatellin

Stigmatellin A is a member of the class of chromones that is isolated from Stigmatella aurantiaca Sg a15. It has a role as a quinol oxidation site inhibitor and a bacterial metabolite. It is a member of chromones, a member of phenols, an aromatic ether and an olefinic compound.

CAS Number91682-96-1
PubChem CID447884
IUPAC Name2-[(3S,4S,5S,6S,7E,9E,11E)-4,6-dimethoxy-3,5,11-trimethyltrideca-7,9,11-trienyl]-8-hydroxy-5,7-dimethoxy-3-methylchromen-4-one
Molecular FormulaC30H42O7
Molecular Weight514.6
XLogP6.3
Topological Polar Surface Area83.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count13
Heavy Atom Count37
Formal Charge0
Complexity858
SMILES
C/C=C(\C)/C=C/C=C/[C@@H]([C@@H](C)[C@H]([C@@H](C)CCC1=C(C(=O)C2=C(O1)C(=C(C=C2OC)OC)O)C)OC)OC
InChI
InChI=1S/C30H42O7/c1-10-18(2)13-11-12-14-22(33-6)21(5)29(36-9)19(3)15-16-23-20(4)27(31)26-24(34-7)17-25(35-8)28(32)30(26)37-23/h10-14,17,19,21-22,29,32H,15-16H2,1-9H3/b13-11+,14-12+,18-10+/t19-,21+,22-,29-/m0/s1
InChIKey
UZHDGDDPOPDJGM-CVOZLMQJSA-N
Chemical Structure
2D Structure
2D structure of Stigmatellin
CAS: 91682-96-1
CID: 447884
Formula: C30H42O7
MW: 514.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight514.6
XLogP36.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count13
Exact Mass514.29305367
Monoisotopic Mass514.29305367
Topological Polar Surface Area83.5 Ų
Heavy Atom Count37
Formal Charge0
Complexity858
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count3
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes