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Peptides

Bottromycin A2

Also known as Bottromycin A(2), MQH

CAS 15005-62-6Formula C42H62N8O7SMolar mass 823.07 g/mol
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Bottromycin A2 chemical structure, C42H62N8O7S, CAS 15005-62-6
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
15005-62-6
Formula
C42H62N8O7S
Molar mass
823.07 g/mol
HS code
293410
Category
Peptides

What is Bottromycin A2?

Plain description, key identifiers and synonyms

Bottromycin A2 is a peptide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
methyl (3R)-3-[[(2S,3S)-2-[[(2S)-2-[[(6S,9S,12S,13R)-6-tert-butyl-13-methyl-2,8,11-trioxo-9-propan-2-yl-1,4,7,10-tetrazabicyclo[10.3.0]pentadec-4-en-5-yl]amino]-3,3-dimethylbutanoyl]amino]-3-phenylbutanoyl]amino]-3-(1,3-thiazol-2-yl)propanoate
CAS number
15005-62-6 CAS number cross-checked
Molecular formula
C42H62N8O7S
InChIKey
KSIZLOPUXFSFNR-XZNJZDOZSA-N
InChI
InChI=1S/C42H62N8O7S/c1-23(2)30-36(53)49-33(41(5,6)7)35(44-22-28(51)50-19-17-24(3)32(50)38(55)46-30)48-34(42(8,9)10)39(56)47-31(25(4)26-15-13-12-14-16-26)37(54)45-27(21-29(52)57-11)40-43-18-20-58-40/h12-16,18,20,23-25,27,30-34H,17,19,21-22H2,1-11H3,(H,44,48)(H,45,54)(H,46,55)(H,47,56)(H,49,53)/t24-,25+,27-,30+,31+,32+,33-,34-/m1/s1
Canonical SMILES
COC(=O)CC(NC(=O)C(NC(=O)C(NC1=NCC(=O)N2CCC(C)C2C(=O)NC(C(C)C)C(=O)NC1C(C)(C)C)C(C)(C)C)C(C)c1ccccc1)c1nccs1
Isomeric SMILES
C[C@@H]1CCN2[C@@H]1C(=O)N[C@H](C(=O)N[C@H](C(=NCC2=O)N[C@H](C(=O)N[C@@H]([C@@H](C)C3=CC=CC=C3)C(=O)N[C@H](CC(=O)OC)C4=NC=CS4)C(C)(C)C)C(C)(C)C)C(C)C

Synonyms

  • Bottromycin A(2)
  • MQH

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
823.07 g/molcalc.
Exact mass
822.4462 Dacalc.
LogP (octanol/water)
3.48calc.
Topological polar surface area
200.3 Ųcalc.
Hydrogen bond donors
5calc.
Hydrogen bond acceptors
11calc.
Rotatable bonds
11calc.
Heavy atoms
58calc.
Rings
4calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.62calc.
Formal charge
0calc.
Stereocentres
8calc.
Lipinski rule of five
Fails (2 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=C1CNC(=O)C2CCCN2C(=O)CN=C(NCC(=O)NC(Cc2ccccc2)C(=O)NCc2nccs2)CN1

O=C1CNC(=O)C2CCCN2C(=O)CN=C(NCC(=O)NC(Cc2ccccc2)C(=O)NCc2nccs2)CN1

4 rings, 40 atoms.

6 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.

Bottromycin A2 suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

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Bottromycin A2 price

Indicative price range per kg from live supplier offers

No published prices right now

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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 Bottromycin A2 is traded under.

HS 2934.10Indicative HS code

Compounds containing an unfused thiazole ring (whether or not hydrogenated) in the…

World exports in 2024
$3.88B
−16.1% vs 2023, imports $3.12B
2019 to 2024
Top exporters
  1. Switzerland * partner reported36.4%
  2. Ireland28.8%
  3. China10.0%
Top importers
  1. Canada33.4%
  2. United States14.4%
  3. Ireland13.1%

* Partner reported figures, a lower bound.

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

The HS code shown for Bottromycin A2 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Bottromycin A2, based on the data on this page

What is Bottromycin A2?

Bottromycin A2 is a peptide.

What is the CAS number of Bottromycin A2?

The CAS registry number of Bottromycin A2 is 15005-62-6.

What is the molecular formula and weight of Bottromycin A2?

The molecular formula of Bottromycin A2 is C42H62N8O7S and its molar mass is 823.07 g/mol.

Is Bottromycin A2 hazardous?

No GHS hazard classification for Bottromycin A2 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 Bottromycin A2?

Bottromycin A2 is usually classified under HS code 293410 (Compounds containing an unfused thiazole ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Bottromycin A2?

Post a free request on CompoundList and suppliers of Bottromycin A2 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Bottromycin A2?

Suppliers quote Bottromycin A2 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 Bottromycin A2

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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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