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Peptides

Cephabacin M2

Also known as Cephabacin M(sub 2)

CAS 99313-76-5Formula C34H55N9O15SMolar mass 861.93 g/mol
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Cephabacin M2 chemical structure, C34H55N9O15S, CAS 99313-76-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
99313-76-5
Formula
C34H55N9O15S
Molar mass
861.93 g/mol
HS code
294190
Category
Peptides

What is Cephabacin M2?

Plain description, key identifiers and synonyms

Cephabacin M2 is a chemical substance with the molecular formula C34H55N9O15S and a molar mass of 861.93 g/mol. Its CAS registry number is 99313-76-5. The IUPAC name is (6R,7S)-3-[[6-amino-4-[[(2S)-1-[[(2S)-5-amino-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-hydroxy-6-oxohexanoyl]oxymethyl]-7-[[(5R)-5-amino-5-carboxypentanoyl]amino]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(6R,7S)-3-[[6-amino-4-[[(2S)-1-[[(2S)-5-amino-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]pentanoyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-hydroxy-6-oxohexanoyl]oxymethyl]-7-[[(5R)-5-amino-5-carboxypentanoyl]amino]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS number
99313-76-5
Molecular formula
C34H55N9O15S
InChIKey
NFOXRFBDGLYOLK-NEVPLHAESA-N
InChI
InChI=1S/C34H55N9O15S/c1-15(2)25(29(51)41-28(50)19(7-5-9-35)40-27(49)18(37)12-44)39-20(10-22(38)46)21(45)11-24(48)58-13-16-14-59-33-34(57-3,32(56)43(33)26(16)31(54)55)42-23(47)8-4-6-17(36)30(52)53/h15,17-21,25,33,39,44-45H,4-14,35-37H2,1-3H3,(H2,38,46)(H,40,49)(H,42,47)(H,52,53)(H,54,55)(H,41,50,51)/t17-,18+,19+,20?,21?,25+,33-,34+/m1/s1
Canonical SMILES
COC1(NC(=O)CCCC(N)C(=O)O)C(=O)N2C(C(=O)O)=C(COC(=O)CC(O)C(CC(N)=O)NC(C(=O)NC(=O)C(CCCN)NC(=O)C(N)CO)C(C)C)CSC21
Isomeric SMILES
CC(C)[C@@H](C(=O)NC(=O)[C@H](CCCN)NC(=O)[C@H](CO)N)NC(CC(=O)N)C(CC(=O)OCC1=C(N2[C@@H]([C@@](C2=O)(NC(=O)CCC[C@H](C(=O)O)N)OC)SC1)C(=O)O)O

Synonyms

  • Cephabacin M(sub 2)

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
861.93 g/molcalc.
Exact mass
861.3538 Dacalc.
LogP (octanol/water)
-5.38calc.
Topological polar surface area
408.5 Ųcalc.
Hydrogen bond donors
12calc.
Hydrogen bond acceptors
18calc.
Rotatable bonds
26calc.
Heavy atoms
59calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.68calc.
Formal charge
0calc.
Stereocentres
8calc.
Lipinski rule of five
Fails (3 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1CC2SCC=CN12

O=C1CC2SCC=CN12

2 rings, 9 atoms.

150 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Cephabacin M2 suppliers

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Cephabacin M2 price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Cephabacin M2 is traded under.

HS 2941.90Indicative HS code

Antibiotics, other

World exports in 2024
$6.39B
+2.3% vs 2023, imports $6.97B
2019 to 2024
Top exporters
  1. China39.7%
  2. United States11.3%
  3. Switzerland * partner reported10.9%
Top importers
  1. Italy15.0%
  2. India * partner reported12.0%
  3. China8.7%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Cephabacin M2 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Cephabacin M2, based on the data on this page

What is Cephabacin M2?

Cephabacin M2 is a chemical substance with the molecular formula C34H55N9O15S and a molar mass of 861.93 g/mol. Its CAS registry number is 99313-76-5.

What is the CAS number of Cephabacin M2?

The CAS registry number of Cephabacin M2 is 99313-76-5.

What is the molecular formula and weight of Cephabacin M2?

The molecular formula of Cephabacin M2 is C34H55N9O15S and its molar mass is 861.93 g/mol.

Is Cephabacin M2 hazardous?

No GHS hazard classification for Cephabacin M2 is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Cephabacin M2?

Cephabacin M2 is usually classified under HS code 294190 (Antibiotics, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Cephabacin M2?

Post a free request on CompoundList and suppliers of Cephabacin M2 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Cephabacin M2?

Suppliers quote Cephabacin M2 on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Cephabacin M2

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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