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Heterocyclic compounds

Lucensimycin E

CAS 1107631-94-6Formula C34H41NO12SMolar mass 687.76 g/mol
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Lucensimycin E chemical structure, C34H41NO12S, CAS 1107631-94-6
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1107631-94-6
Formula
C34H41NO12S
Molar mass
687.76 g/mol
HS code
293220
Category
Heterocyclic compounds

What is Lucensimycin E?

Plain description, key identifiers and synonyms

Lucensimycin E is an organic heterotetracyclic compound isolated from the bacterial strain Streptomyces lucensis MA7349 and has been shown to exhibit antibacterial activity. It has a role as an antimicrobial agent, an antibacterial agent and a bacterial metabolite. It is an organic sulfide, a member of acetamides, a dicarboxylic acid, an oxaspiro compound, an organic heterotetracyclic compound, an acetate ester and a ketolactone.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2E,4E,6E)-7-[(2S,3R,4aS,4bS,5'S,6R,7R,8S,8aR,10aR)-5'-[[(2S)-2-acetamido-2-carboxyethyl]sulfanylmethyl]-6-acetyloxy-8-hydroxy-4a,7-dimethyl-2',4,4'-trioxospiro[2,4b,5,6,7,8,8a,10a-octahydro-1H-phenanthrene-3,3'-oxolane]-2-yl]hepta-2,4,6-trienoic acid
CAS number
1107631-94-6
Molecular formula
C34H41NO12S
InChIKey
PTLQDKFYOYMVQN-CECFYEBASA-N
InChI
InChI=1S/C34H41NO12S/c1-17-25(46-19(3)37)14-23-22(28(17)40)12-11-20-13-21(9-7-5-6-8-10-27(38)39)34(31(44)33(20,23)4)29(41)26(47-32(34)45)16-48-15-24(30(42)43)35-18(2)36/h5-12,17,20-26,28,40H,13-16H2,1-4H3,(H,35,36)(H,38,39)(H,42,43)/b6-5+,9-7+,10-8+/t17-,20-,21+,22+,23-,24+,25+,26+,28+,33-,34-/m0/s1
Canonical SMILES
CC(=O)NC(CSCC1OC(=O)C2(C1=O)C(=O)C1(C)C(C=CC3C(O)C(C)C(OC(C)=O)CC31)CC2C=CC=CC=CC(=O)O)C(=O)O
Isomeric SMILES
C[C@H]1[C@@H](C[C@H]2[C@H]([C@@H]1O)C=C[C@@H]3[C@@]2(C(=O)[C@]4([C@@H](C3)/C=C/C=C/C=C/C(=O)O)C(=O)[C@H](OC4=O)CSC[C@H](C(=O)O)NC(=O)C)C)OC(=O)C

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
687.76 g/molcalc.
Exact mass
687.2349 Dacalc.
LogP (octanol/water)
1.89calc.
Topological polar surface area
210.7 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
11calc.
Rotatable bonds
11calc.
Heavy atoms
48calc.
Rings
4calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.56calc.
Formal charge
0calc.
Stereocentres
11calc.
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=C1COC(=O)C12CCC1C=CC3CCCCC3C1C2=O

O=C1COC(=O)C12CCC1C=CC3CCCCC3C1C2=O

4 rings, 21 atoms.

2 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.

Lucensimycin E suppliers

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Lucensimycin E 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

Roles

  • antibacterial agent
  • antimicrobial agent
  • bacterial metabolite
  • metabolite
  • prokaryotic metabolite

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 Lucensimycin E is traded under.

HS 2932.20Indicative HS code

Lactones

World exports in 2024
$1.97B
−4.7% vs 2023, imports $2.07B
2019 to 2024
Top exporters
  1. China56.3%
  2. India * partner reported7.4%
  3. Germany7.3%
Top importers
  1. United States14.2%
  2. India * partner reported13.5%
  3. Brazil8.5%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Lucensimycin E, based on the data on this page

What is Lucensimycin E?

Lucensimycin E is an organic heterotetracyclic compound isolated from the bacterial strain Streptomyces lucensis MA7349 and has been shown to exhibit antibacterial activity. It has a role as an antimicrobial agent, an antibacterial agent and a bacterial metabolite.

What is the CAS number of Lucensimycin E?

The CAS registry number of Lucensimycin E is 1107631-94-6.

What is the molecular formula and weight of Lucensimycin E?

The molecular formula of Lucensimycin E is C34H41NO12S and its molar mass is 687.76 g/mol.

What is Lucensimycin E used for?

Known uses and roles of Lucensimycin E include antibacterial agent, antimicrobial agent, bacterial metabolite, metabolite and prokaryotic metabolite.

Is Lucensimycin E hazardous?

No GHS hazard classification for Lucensimycin E 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 Lucensimycin E?

Lucensimycin E is usually classified under HS code 293220 (Lactones). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Lucensimycin E?

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

What is the price of Lucensimycin E?

Suppliers quote Lucensimycin E 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 Lucensimycin E

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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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