Argifin

CAT: 0607-BA2132-1Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0607-BA2132-1Size:1 mg

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CAS Number

243975-37-3

Form

A solid

Molecular Formula

C29H41N9O10

Molecular Weight

675.69

Shipping Conditions

Blue ice

Storage Conditions

Tightly sealed and desiccated at -20°C, protect from light.

Chemical Information

Argifin

Argifin has been reported in Gliocladium with data available.

CAS Number	243975-37-3
PubChem CID	449124
IUPAC Name	(2R,5S,8S,11S,15S)-5-[3-[[amino-(methylcarbamoylamino)methylidene]amino]propyl]-8-benzyl-2,7-dimethyl-3,6,9,13,17-pentaoxo-1,4,7,10,14-pentazacycloheptadecane-11,15-dicarboxylic acid
Molecular Formula	C29H41N9O10
Molecular Weight	675.7
XLogP	-1.9
Topological Polar Surface Area	291
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	9
Heavy Atom Count	48
Formal Charge	0
Complexity	1250

SMILES

C[C@@H]1C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N1)C(=O)O)C(=O)O)CC2=CC=CC=C2)C)CCCN=C(N)NC(=O)NC

InChI

InChI=1S/C29H41N9O10/c1-15-23(41)35-17(10-7-11-32-28(30)37-29(48)31-2)25(43)38(3)20(12-16-8-5-4-6-9-16)24(42)36-19(27(46)47)14-22(40)34-18(26(44)45)13-21(39)33-15/h4-6,8-9,15,17-20H,7,10-14H2,1-3H3,(H,33,39)(H,34,40)(H,35,41)(H,36,42)(H,44,45)(H,46,47)(H4,30,31,32,37,48)/t15-,17+,18+,19+,20+/m1/s1

InChIKey

UHBHXSDKGLPPGO-HTDHLNIYSA-N

Chemical Structure

2D Structure

CAS: 243975-37-3

CID: 449124

Formula: C29H41N9O10

MW: 675.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	675.7
XLogP3	-1.9
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	9
Exact Mass	675.29763854
Monoisotopic Mass	675.29763854
Topological Polar Surface Area	291 Å²
Heavy Atom Count	48
Formal Charge	0
Complexity	1250
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
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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Alternative Products

Catalog	Name
TP2140-01	Argifin
HY-P2274R	Argifin (Standard)
HY-CE01211	Argifin-CoA

Argifin

Chemical Information

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