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Heterocyclic building blocks

Saquayamycin E

CAS 178484-51-0Formula C43H50O16Molar mass 822.86 g/mol
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Saquayamycin E chemical structure, C43H50O16, CAS 178484-51-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
178484-51-0
Formula
C43H50O16
Molar mass
822.86 g/mol
HS code
293299
Category
Heterocyclic building blocks

What is Saquayamycin E?

Plain description, key identifiers and synonyms

Saquayamycin E is an angucycline.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4a,8,12b-trihydroxy-9-[4-hydroxy-6-methyl-5-[(6-methyl-5-oxo-2H-pyran-2-yl)oxy]oxan-2-yl]-3-methyl-3-[6-methyl-5-(6-methyl-5-oxooxan-2-yl)oxyoxan-2-yl]oxy-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
CAS number
178484-51-0
Molecular formula
C43H50O16
InChIKey
VWFXKMIXHGVTNY-UHFFFAOYSA-N
InChI
InChI=1S/C43H50O16/c1-19-26(44)8-11-32(54-19)57-29-10-13-34(56-21(29)3)59-41(5)17-31(47)43(52)36-25(14-15-42(43,51)18-41)38(49)35-24(39(36)50)7-6-23(37(35)48)30-16-28(46)40(22(4)53-30)58-33-12-9-27(45)20(2)55-33/h6-7,9,12,14-15,19-22,28-30,32-34,40,46,48,51-52H,8,10-11,13,16-18H2,1-5H3
SMILES (canonical and isomeric)
CC1C(CCC(O1)OC2(CC(=O)C3(C4=C(C=CC3(C2)O)C(=O)C5=C(C4=O)C=CC(=C5O)C6CC(C(C(O6)C)OC7C=CC(=O)C(O7)C)O)O)C)OC8CCC(=O)C(O8)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
822.86 g/molcalc.
Exact mass
822.3099 Dacalc.
LogP (octanol/water)
2.71calc.
Topological polar surface area
230.9 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
16calc.
Rotatable bonds
7calc.
Heavy atoms
59calc.
Rings
8calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.61calc.
Formal charge
0calc.
Stereocentres
14calc.
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=C1C=CC(OC2CCC(c3ccc4c(c3)C(=O)C3=C(C4=O)C4C(=O)CC(OC5CCC(OC6CCC(=O)CO6)CO5)CC4C=C3)OC2)OC1

O=C1C=CC(OC2CCC(c3ccc4c(c3)C(=O)C3=C(C4=O)C4C(=O)CC(OC5CCC(OC6CCC(=O)CO6)CO5)CC4C=C3)OC2)OC1

8 rings, 50 atoms.

No other chemical in our database has 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.

Saquayamycin E suppliers

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Saquayamycin 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

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 Saquayamycin E is traded under.

HS 2932.99Indicative HS code

Heterocyclic compounds with oxygen hetero-atom(s) only, other

World exports in 2024
$3.81B
+10.3% vs 2023, imports $7.05B
2019 to 2024
Top exporters
  1. China28.9%
  2. Switzerland * partner reported12.7%
  3. Germany7.8%
Top importers
  1. United States49.7%
  2. China11.9%
  3. India * partner reported3.3%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Saquayamycin E?

Saquayamycin E is an angucycline.

What is the CAS number of Saquayamycin E?

The CAS registry number of Saquayamycin E is 178484-51-0.

What is the molecular formula and weight of Saquayamycin E?

The molecular formula of Saquayamycin E is C43H50O16 and its molar mass is 822.86 g/mol.

What is Saquayamycin E used for?

Known uses and roles of Saquayamycin E include building blocks in research and laboratory.

Is Saquayamycin E hazardous?

No GHS hazard classification for Saquayamycin 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 Saquayamycin E?

Saquayamycin E is usually classified under HS code 293299 (Heterocyclic compounds with oxygen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Saquayamycin E?

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

What is the price of Saquayamycin E?

Suppliers quote Saquayamycin 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 Saquayamycin 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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