Hormaomycin

CAT: 0931-TP2788-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-TP2788-01Size:10 mg

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

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CAS Number

121548-21-8

Bioactivity

Hormaomycin is an effective and selective macrolide antibiotic with broad-spectrum antimicrobial activity against various Gram-positive bacteria.

Smiles

O=[N+]([C@H](C1)[C@@H]1C[C@H](C(N[C@@](C(N[C@@]2([H])[C@@H](C)CC)=O)([H])[C@@H](C3=CC=CC=C3)C)=O)NC([C@@]([C@@H](C4=CC=CC=C4)C)([H])NC([C@H](NC([C@@H](NC(C5=CC=C(N5O)Cl)=O)C[C@H]6[C@H]([N+]([O-])=O)C6)=O)[C@@H](C)OC([C@@](C[C@@H](C7)/C=C\C)([H])N7C2=O)=O)=O)=O)[O-]

Molecular Formula

C55H69ClN10O14

Molecular Weight

1129.65

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

CID 101249323

CAS Number	121548-21-8
PubChem CID	101249323
IUPAC Name	N-[1-[[3-butan-2-yl-16-methyl-9-[(2-nitrocyclopropyl)methyl]-2,5,8,11,14,18-hexaoxo-6,12-bis(1-phenylethyl)-21-[(E)-prop-1-enyl]-17-oxa-1,4,7,10,13-pentazabicyclo[17.3.0]docosan-15-yl]amino]-3-(2-nitrocyclopropyl)-1-oxopropan-2-yl]-5-chloro-1-hydroxypyrrole-2-carboxamide
Molecular Formula	C55H69ClN10O14
Molecular Weight	1129.6
XLogP	7.2
Topological Polar Surface Area	338
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	15
Heavy Atom Count	80
Formal Charge	0
Complexity	2320

SMILES

CCC(C)C1C(=O)N2CC(CC2C(=O)OC(C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)C(C)C3=CC=CC=C3)CC4CC4[N+](=O)[O-])C(C)C5=CC=CC=C5)NC(=O)C(CC6CC6[N+](=O)[O-])NC(=O)C7=CC=C(N7O)Cl)C)/C=C/C

InChI

InChI=1S/C55H69ClN10O14/c1-7-15-32-22-42-55(74)80-31(6)47(62-49(68)37(23-35-25-40(35)65(76)77)57-50(69)39-20-21-43(56)64(39)75)53(72)61-45(29(4)33-16-11-9-12-17-33)51(70)58-38(24-36-26-41(36)66(78)79)48(67)60-46(30(5)34-18-13-10-14-19-34)52(71)59-44(28(3)8-2)54(73)63(42)27-32/h7,9-21,28-32,35-38,40-42,44-47,75H,8,22-27H2,1-6H3,(H,57,69)(H,58,70)(H,59,71)(H,60,67)(H,61,72)(H,62,68)/b15-7+

InChIKey

YOUXQVRIWHZWQN-VIZOYTHASA-N

Chemical Structure

2D Structure

CAS: 121548-21-8

CID: 101249323

Formula: C55H69ClN10O14

MW: 1129.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	1129.6
XLogP3	7.2
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	15
Exact Mass	1128.4683246
Monoisotopic Mass	1128.4683246
Topological Polar Surface Area	338 Å²
Heavy Atom Count	80
Formal Charge	0
Complexity	2320
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	16
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
GTR19066019-01	Hormaomycin

Hormaomycin

Chemical Information

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