Products for Research Use Only
RegisterLogin

Chrysamide B

CAT: 0926-YDD42592-01Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-YDD42592-01Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1973425-92-1
Smiles
CC1CN (C (CN1C (=O) C2 (C (O2) C3=CC=C (C=C3) [N+] (=O) [O-]) C) C) C (=O) C4 (C (O4) C5=CC=C (C=C5) [N+] (=O) [O-]) C
Molecular Formula
C26H28N4O8
Molecular Weight
524.5 g/mol
Controlled
No

Chemical Information

Chrysamide B

Chrysamide B is a C-nitro compound.

CAS Number1973425-92-1
PubChem CID132515915
IUPAC Name[(2R,5R)-2,5-dimethyl-4-[(2S,3R)-2-methyl-3-(4-nitrophenyl)oxirane-2-carbonyl]piperazin-1-yl]-[(2S,3R)-2-methyl-3-(4-nitrophenyl)oxiran-2-yl]methanone
Molecular FormulaC26H28N4O8
Molecular Weight524.5
XLogP2.3
Topological Polar Surface Area157
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count38
Formal Charge0
Complexity905
SMILES
C[C@@H]1CN([C@@H](CN1C(=O)[C@@]2([C@H](O2)C3=CC=C(C=C3)[N+](=O)[O-])C)C)C(=O)[C@@]4([C@H](O4)C5=CC=C(C=C5)[N+](=O)[O-])C
InChI
InChI=1S/C26H28N4O8/c1-15-13-28(24(32)26(4)22(38-26)18-7-11-20(12-8-18)30(35)36)16(2)14-27(15)23(31)25(3)21(37-25)17-5-9-19(10-6-17)29(33)34/h5-12,15-16,21-22H,13-14H2,1-4H3/t15-,16-,21-,22-,25+,26+/m1/s1
InChIKey
PNZUHMALUWDEMC-AENRNCCWSA-N
Chemical Structure
2D Structure
2D structure of Chrysamide B
CAS: 1973425-92-1
CID: 132515915
Formula: C26H28N4O8
MW: 524.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight524.5
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass524.19071386
Monoisotopic Mass524.19071386
Topological Polar Surface Area157 Ų
Heavy Atom Count38
Formal Charge0
Complexity905
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
EN36498-01B-Naphthyl-b-maltotrioside
HHB63110-01B-Hydroxy 2C-B hydrochloride
MT184248Tri-b-GalNAc-b-alanine-NH2
OL15748-01B-Lactose - min 70% b-anomer
ZIB77761-01Erigoster B
LBA15101-01Blumenol B
KPC04661-01Aspidostomide B
KCA58714-01Tirandamycin B
JHB23787-01Gnetumontanin B
JEA23276-01Camellianin B

Alternative Products

CatalogName
444525Chrysamide B

Popular Products