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Heterocyclic building blocks

Orb1692359

CAS 144860-68-4Formula C36H52O11Molar mass 660.80 g/mol
1 supplier listed
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Orb1692359 chemical structure, C36H52O11, CAS 144860-68-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
144860-68-4
Formula
C36H52O11
Molar mass
660.80 g/mol
HS code
293219
Category
Heterocyclic building blocks

What is Orb1692359?

Plain description, key identifiers and synonyms

reveromycin B has been reported in Streptomyces.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2E,4S,5S,6E,8E)-10-[(2R,5S,8S,9R)-2-butyl-2-[(1S,2E,4E)-5-carboxy-1-(3-carboxypropanoyloxy)-4-methylpenta-2,4-dienyl]-8-methyl-1,10-dioxaspiro[4.5]decan-9-yl]-5-hydroxy-4,8-dimethyldeca-2,6,8-trienoic acid
CAS number
144860-68-4
Molecular formula
C36H52O11
InChIKey
XVFQIVPMOPJEIO-OXVOKJAASA-N
InChI
InChI=1S/C36H52O11/c1-6-7-19-35(30(14-10-25(3)23-33(42)43)45-34(44)17-16-32(40)41)21-22-36(47-35)20-18-27(5)29(46-36)13-9-24(2)8-12-28(37)26(4)11-15-31(38)39/h8-12,14-15,23,26-30,37H,6-7,13,16-22H2,1-5H3,(H,38,39)(H,40,41)(H,42,43)/b12-8+,14-10+,15-11+,24-9+,25-23+/t26-,27-,28-,29+,30-,35+,36-/m0/s1
Canonical SMILES
CCCCC1(C(C=CC(C)=CC(=O)O)OC(=O)CCC(=O)O)CCC2(CCC(C)C(CC=C(C)C=CC(O)C(C)C=CC(=O)O)O2)O1
Isomeric SMILES
CCCC[C@@]1(CC[C@@]2(O1)CC[C@@H]([C@H](O2)C/C=C(\C)/C=C/[C@@H]([C@@H](C)/C=C/C(=O)O)O)C)[C@H](/C=C/C(=C/C(=O)O)/C)OC(=O)CCC(=O)O

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
660.80 g/molcalc.
Exact mass
660.351 Dacalc.
LogP (octanol/water)
6.13calc.
Topological polar surface area
176.9 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
18calc.
Heavy atoms
47calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.61calc.
Formal charge
0calc.
Stereocentres
7calc.
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, C1CCC2(CCCO2)OC1

C1CCC2(CCCO2)OC1

2 rings, 10 atoms.

11 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.

Orb1692359 suppliers

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Where suppliers are based

1 supplier in 1 country

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Orb1692359 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 Orb1692359 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 Orb1692359 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb1692359, based on the data on this page

What is Orb1692359?

reveromycin B has been reported in Streptomyces.

What is the CAS number of Orb1692359?

The CAS registry number of Orb1692359 is 144860-68-4.

What is the molecular formula and weight of Orb1692359?

The molecular formula of Orb1692359 is C36H52O11 and its molar mass is 660.80 g/mol.

What is Orb1692359 used for?

Known uses and roles of Orb1692359 include building blocks in research and laboratory.

Is Orb1692359 hazardous?

No GHS hazard classification for Orb1692359 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 Orb1692359?

Orb1692359 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 Orb1692359?

CompoundList lists 1 supplier of Orb1692359 in Australia. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Orb1692359?

Suppliers quote Orb1692359 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

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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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