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Amphoteric surfactants

Bacillomycin D

CAS 76012-17-4Formula C49H76N10O15Molar mass 1,045.20 g/mol
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Bacillomycin D chemical structure, C49H76N10O15, CAS 76012-17-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
76012-17-4
Formula
C49H76N10O15
Molar mass
1,045.20 g/mol
HS code
293379
Category
Amphoteric surfactants

What is Bacillomycin D?

Plain description, key identifiers and synonyms

Bacillomycin D has been reported in Bacillus subtilis and Bacillus velezensis.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-[3,9-bis(2-amino-2-oxoethyl)-16-(1-hydroxyethyl)-19-(hydroxymethyl)-6-[(4-hydroxyphenyl)methyl]-13-(9-methylundecyl)-2,5,8,11,15,18,21,24-octaoxo-1,4,7,10,14,17,20,23-octazabicyclo[23.3.0]octacosan-22-yl]propanoic acid
CAS number
76012-17-4
Molecular formula
C49H76N10O15
InChIKey
DFIMCVVZHWXEGI-UHFFFAOYSA-N
InChI
InChI=1S/C49H76N10O15/c1-4-27(2)12-9-7-5-6-8-10-13-30-23-40(65)53-34(24-38(50)63)45(70)55-33(22-29-15-17-31(62)18-16-29)44(69)56-35(25-39(51)64)49(74)59-21-11-14-37(59)47(72)54-32(19-20-41(66)67)43(68)57-36(26-60)46(71)58-42(28(3)61)48(73)52-30/h15-18,27-28,30,32-37,42,60-62H,4-14,19-26H2,1-3H3,(H2,50,63)(H2,51,64)(H,52,73)(H,53,65)(H,54,72)(H,55,70)(H,56,69)(H,57,68)(H,58,71)(H,66,67)
SMILES (canonical and isomeric)
CCC(C)CCCCCCCCC1CC(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)C(C)O)CO)CCC(=O)O)CC(=O)N)CC3=CC=C(C=C3)O)CC(=O)N

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
1,045.20 g/molcalc.
Exact mass
1,044.5492 Dacalc.
LogP (octanol/water)
-2.12calc.
Topological polar surface area
408.2 Ųcalc.
Hydrogen bond donors
13calc.
Hydrogen bond acceptors
14calc.
Rotatable bonds
21calc.
Heavy atoms
74calc.
Rings
3calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.65calc.
Formal charge
0calc.
Stereocentres
10calc.
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=C1CCNC(=O)CNC(=O)CNC(=O)CNC(=O)C2CCCN2C(=O)CNC(=O)C(Cc2ccccc2)NC(=O)CN1

O=C1CCNC(=O)CNC(=O)CNC(=O)CNC(=O)C2CCCN2C(=O)CNC(=O)C(Cc2ccccc2)NC(=O)CN1

3 rings, 43 atoms.

1 other chemical 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.

Bacillomycin D suppliers

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Bacillomycin D 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

Industries and functions

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 Bacillomycin D is traded under.

HS 2933.79Indicative HS code

Lactams, other lactams

World exports in 2024
$16.2B
−64.4% vs 2023, imports $15.4B
2019 to 2024
Top exporters
  1. Ireland37.0%
  2. France * partner reported15.6%
  3. Spain11.3%
Top importers
  1. Germany27.8%
  2. Ireland18.9%
  3. Panama * partner reported12.9%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Bacillomycin D, based on the data on this page

What is Bacillomycin D?

Bacillomycin D has been reported in Bacillus subtilis and Bacillus velezensis.

What is the CAS number of Bacillomycin D?

The CAS registry number of Bacillomycin D is 76012-17-4.

What is the molecular formula and weight of Bacillomycin D?

The molecular formula of Bacillomycin D is C49H76N10O15 and its molar mass is 1,045.20 g/mol.

What is Bacillomycin D used for?

Known uses and roles of Bacillomycin D include surfactants in home care and cleaning.

Is Bacillomycin D hazardous?

No GHS hazard classification for Bacillomycin D 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 Bacillomycin D?

Bacillomycin D is usually classified under HS code 293379 (Lactams, other lactams). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Bacillomycin D?

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

What is the price of Bacillomycin D?

Suppliers quote Bacillomycin D 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 Bacillomycin D

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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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