Pyridomycin

CAT: 0498-bs-75783CSize: 1 mgDry Ice: NoHazardous: No

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CAT#:0498-bs-75783CSize:1 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

18791-21-4

Conjugation

Unconjugated

Purity

>98% (1H-NMR, HPLC)

Buffer

Solid

Solubility

Soluble in DMSO, methanol, water, dichloromethane or acetone.

Smiles

CC\C(C)=C1/OC(=O)[C@H](C)[C@H](O)[C@H](CC2=CC=CN=C2)NC(=O)[C@@H](NC(=O)C2=C(O)C=CC=N2)[C@@H](C)OC1=O

Molecular Formula

C27H32N4O8

Molecular Weight

540.6

Storage Conditions

Stable for 1 year after receipt when stored at +4°C.

Appearance

Off-white solid.

Chemical Information

3-Hydroxy-N-((2Z,5R,6S,9S,10S,11R)-10-hydroxy-5,11-dimethyl-2-(1-methylpropylidene)-3,7,12-trioxo-9-(3-pyridinylmethyl)-1,4-dioxa-8-azacyclododec-6-yl)-2-pyridinecarboxamide

extract of Streptomyces

CAS Number	18791-21-4
PubChem CID	3037036
IUPAC Name	N-[(2Z,5R,6S,9S,10S,11R)-2-butan-2-ylidene-10-hydroxy-5,11-dimethyl-3,7,12-trioxo-9-(pyridin-3-ylmethyl)-1,4-dioxa-8-azacyclododec-6-yl]-3-hydroxypyridine-2-carboxamide
Molecular Formula	C27H32N4O8
Molecular Weight	540.6
XLogP	2.8
Topological Polar Surface Area	177
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	5
Heavy Atom Count	39
Formal Charge	0
Complexity	941

SMILES

CC/C(=C\1/C(=O)O[C@@H]([C@@H](C(=O)N[C@H]([C@H]([C@H](C(=O)O1)C)O)CC2=CN=CC=C2)NC(=O)C3=C(C=CC=N3)O)C)/C

InChI

InChI=1S/C27H32N4O8/c1-5-14(2)23-27(37)38-16(4)20(31-25(35)21-19(32)9-7-11-29-21)24(34)30-18(12-17-8-6-10-28-13-17)22(33)15(3)26(36)39-23/h6-11,13,15-16,18,20,22,32-33H,5,12H2,1-4H3,(H,30,34)(H,31,35)/b23-14-/t15-,16-,18+,20+,22+/m1/s1

InChIKey

WHIKSLGSXKIHCA-IGCCMALHSA-N

Chemical Structure

2D Structure

CAS: 18791-21-4

CID: 3037036

Formula: C27H32N4O8

MW: 540.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	540.6
XLogP3	2.8
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	5
Exact Mass	540.22201399
Monoisotopic Mass	540.22201399
Topological Polar Surface Area	177 Å²
Heavy Atom Count	39
Formal Charge	0
Complexity	941
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
P100-2.5MG	Pyridomycin

Pyridomycin

Chemical Information

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