Feigrisolide C

CAT: 0013-GTR19254503-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19254503-02Size:50 mg

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Description

Feigrisolide C is a lactone produced by the bacterium Streptomyces griseus.

CAS Number

313949-18-7

Field of Research

Infectious Disease & Virology

Smiles

[C@H] (C (O[C@H] (C[C@H]1O[C@@] ([C@H] (C (O) =O) C) (CC1) [H]) C) =O) (C) [C@]2 (O[C@@H] (C[C@@H] (CC) O) CC2) [H]

Molecular Formula

C21H36O7

Molecular Weight

400.506

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

(2R)-2-[(2R,5S)-5-[(2S)-2-[(2S)-2-[(2S,5R)-5-[(2R)-2-hydroxybutyl]oxolan-2-yl]propanoyl]oxypropyl]oxolan-2-yl]propanoic acid

(R)-2-[(2R)-Tetrahydro-5beta-[(S)-2-[[(S)-2-[(2S)-5alpha-[(R)-2-hydroxybutyl]tetrahydrofuran-2alpha-yl]propanoyl]oxy]propyl]furan-2beta-yl]propanoic acid has been reported in Streptomyces griseus with data available.

CAS Number	313949-18-7
PubChem CID	11502215
IUPAC Name	(2R)-2-[(2R,5S)-5-[(2S)-2-[(2S)-2-[(2S,5R)-5-[(2R)-2-hydroxybutyl]oxolan-2-yl]propanoyl]oxypropyl]oxolan-2-yl]propanoic acid
Molecular Formula	C21H36O7
Molecular Weight	400.5
XLogP	3.1
Topological Polar Surface Area	102
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	11
Heavy Atom Count	28
Formal Charge	0
Complexity	523

SMILES

CC[C@H](C[C@H]1CC[C@H](O1)[C@H](C)C(=O)O[C@@H](C)C[C@@H]2CC[C@@H](O2)[C@@H](C)C(=O)O)O

InChI

InChI=1S/C21H36O7/c1-5-15(22)11-17-7-9-19(28-17)14(4)21(25)26-12(2)10-16-6-8-18(27-16)13(3)20(23)24/h12-19,22H,5-11H2,1-4H3,(H,23,24)/t12-,13+,14-,15+,16-,17+,18+,19-/m0/s1

InChIKey

JZCRGJSEBZCNAR-AJXUQBSVSA-N

Chemical Structure

2D Structure

CAS: 313949-18-7

CID: 11502215

Formula: C21H36O7

MW: 400.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	400.5
XLogP3	3.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	11
Exact Mass	400.24610348
Monoisotopic Mass	400.24610348
Topological Polar Surface Area	102 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	523
Isotope Atom Count	0
Defined Atom Stereocenter Count	8
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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HY-N14317	Feigrisolide A
HY-N14318	Feigrisolide B
TN9990-01	Feigrisolide D
HY-N14319	Feigrisolide C

Feigrisolide C

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