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Heterocyclic compounds

Martinomycin

Also known as LL-D 37187alpha, Martinomycin

CAS 160791-16-2Formula C49H84O17Molar mass 945.19 g/mol
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Martinomycin chemical structure, C49H84O17, CAS 160791-16-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
160791-16-2
Formula
C49H84O17
Molar mass
945.19 g/mol
HS code
293219
Category
Heterocyclic compounds

What is Martinomycin?

Plain description, key identifiers and synonyms

Martinomycin is a C-glycosyl compound.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2R)-2-[(2S,3S,4S,5S,6S)-2-hydroxy-6-[[(2R,3R,4R,5S,6R,7R,9S)-2-[(2R,5S)-5-[(2R,5R)-5-[(2S,3S,4S,5R,6S)-6-hydroxy-4-[(2R,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxy-3,5,6-trimethyloxan-2-yl]oxolan-2-yl]oxolan-2-yl]-3,7-dimethoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-9-yl]methyl]-4,5-dimethoxy-3,5-dimethyloxan-2-yl]propanoic acid
CAS number
160791-16-2
Molecular formula
C49H84O17
InChIKey
VIAPPZHHJMCDEJ-JXBMCXTESA-N
InChI
InChI=1S/C49H84O17/c1-24-40(62-39-21-19-32(54-11)30(7)59-39)26(3)47(10,52)65-41(24)35-17-16-33(60-35)34-18-20-37(61-34)46(9)43(57-14)28(5)49(66-46)25(2)36(55-12)22-31(63-49)23-38-45(8,58-15)42(56-13)27(4)48(53,64-38)29(6)44(50)51/h24-43,52-53H,16-23H2,1-15H3,(H,50,51)/t24-,25+,26+,27-,28+,29-,30+,31-,32-,33+,34-,35+,36+,37+,38-,39-,40-,41-,42-,43+,45-,46+,47-,48-,49-/m0/s1
Canonical SMILES
COC1CCC(OC2C(C)C(C3CCC(C4CCC(C5(C)OC6(OC(CC7OC(O)(C(C)C(=O)O)C(C)C(OC)C7(C)OC)CC(OC)C6C)C(C)C5OC)O4)O3)OC(C)(O)C2C)OC1C
Isomeric SMILES
C[C@@H]1[C@H](O[C@]([C@@H]([C@H]1O[C@H]2CC[C@@H]([C@H](O2)C)OC)C)(C)O)[C@H]3CC[C@@H](O3)[C@@H]4CC[C@@H](O4)[C@@]5([C@@H]([C@H]([C@@]6(O5)[C@@H]([C@@H](C[C@H](O6)C[C@H]7[C@]([C@H]([C@@H]([C@](O7)([C@@H](C)C(=O)O)O)C)OC)(C)OC)OC)C)C)OC)C

Synonyms

  • LL-D 37187alpha, Martinomycin

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
945.19 g/molcalc.
Exact mass
944.5709 Dacalc.
LogP (octanol/water)
5.22calc.
Topological polar surface area
197.8 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
16calc.
Rotatable bonds
14calc.
Heavy atoms
66calc.
Rings
7calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.98calc.
Formal charge
0calc.
Stereocentres
25calc.
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, C1CCC(CC2CCCC3(CCC(C4CCC(C5CCC(C6CC(OC7CCCCO7)CCO6)O5)O4)O3)O2)OC1

C1CCC(CC2CCCC3(CCC(C4CCC(C5CCC(C6CC(OC7CCCCO7)CCO6)O5)O4)O3)O2)OC1

7 rings, 40 atoms.

4 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.

Martinomycin suppliers

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Martinomycin 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 Martinomycin is traded under.

HS 2932.19Indicative HS code

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

World exports in 2024
$2.62B
−6.4% vs 2023, imports $2.56B
2019 to 2024
Top exporters
  1. Germany57.9%
  2. Italy11.5%
  3. China10.4%
Top importers
  1. Greece40.4%
  2. Japan16.3%
  3. Germany12.8%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Martinomycin, based on the data on this page

What is Martinomycin?

Martinomycin is a C-glycosyl compound.

What is the CAS number of Martinomycin?

The CAS registry number of Martinomycin is 160791-16-2.

What is the molecular formula and weight of Martinomycin?

The molecular formula of Martinomycin is C49H84O17 and its molar mass is 945.19 g/mol.

Is Martinomycin hazardous?

No GHS hazard classification for Martinomycin 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 Martinomycin?

Martinomycin is usually classified under HS code 293219 (Compounds containing an unfused furan ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Martinomycin?

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What is the price of Martinomycin?

Suppliers quote Martinomycin 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 Martinomycin

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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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