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Amino acids and derivatives

LY 382884

Also known as (3S,4aR,6S,8aR)-6-[(4-carboxyphenyl)methyl]-decahydroisoquinoline-3-carboxylic acid, (3S,4aR,6S,8aR)-6-((4-carboxyphenyl)methyl)-decahydroisoquinoline-3-carboxylic acid, (3S,4aR,6S,8aR)-6-[(4-carboxyphenyl)methyl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid

CAS 211566-75-5Formula C18H23NO4Molar mass 317.39 g/mol
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LY 382884 chemical structure, C18H23NO4, CAS 211566-75-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
211566-75-5
Formula
C18H23NO4
Molar mass
317.39 g/mol
HS code
293349
Category
Amino acids and derivatives

What is LY 382884?

Plain description, key identifiers and synonyms

LY382884 is a member of benzoic acids.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(3S,4aR,6S,8aR)-6-[(4-carboxyphenyl)methyl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid
CAS number
211566-75-5
Molecular formula
C18H23NO4
InChIKey
YVMADKYPKNLVGU-BVUBDWEXSA-N
InChI
InChI=1S/C18H23NO4/c20-17(21)13-4-1-11(2-5-13)7-12-3-6-14-10-19-16(18(22)23)9-15(14)8-12/h1-2,4-5,12,14-16,19H,3,6-10H2,(H,20,21)(H,22,23)/t12-,14+,15-,16+/m1/s1
Canonical SMILES
O=C(O)c1ccc(CC2CCC3CNC(C(=O)O)CC3C2)cc1
Isomeric SMILES
C1C[C@H]2CN[C@@H](C[C@H]2C[C@H]1CC3=CC=C(C=C3)C(=O)O)C(=O)O

Synonyms

  • (3S,4aR,6S,8aR)-6-[(4-carboxyphenyl)methyl]-decahydroisoquinoline-3-carboxylic acid
  • (3S,4aR,6S,8aR)-6-((4-carboxyphenyl)methyl)-decahydroisoquinoline-3-carboxylic acid
  • (3S,4aR,6S,8aR)-6-[(4-carboxyphenyl)methyl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid
  • (3S,4aR,6S,8aR)-6-[(4-Carboxyphenyl)methyl]decahydro-3-isoquinolinecarboxylic acid
  • 3-Isoquinolinecarboxylic acid, 6-[(4-carboxyphenyl)methyl]decahydro-, (3S,4aR,6S,8aR)-
  • (3S, 4aR,6S, 8aR)-6-((4-carboxyphenyl)methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid)
  • 6-(4-Carboxy-benzyl)-decahydro-isoquinoline-3-carboxylic acid
  • (3S,4aR,6S,8aR)-6-(4-Carboxy-benzyl)-decahydro-isoquinoline-3-carboxylic acid
  • (3S,4aR,6S,8aR)-6-[(4-Carboxyphenyl)methyl]decahydroisoquinoline-3-carboxylic acid
  • (3s,4ar,6s,8ar)-6-(4-carboxyphenyl)methyl-1,2,3,4,4a,5,6,7,8,8a-decahydro isoquinoline-3-carboxylic acid

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
317.39 g/molcalc.
Exact mass
317.1627 Dacalc.
LogP (octanol/water)
2.41calc.
Topological polar surface area
86.63 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
4calc.
Heavy atoms
23calc.
Rings
3calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.56calc.
Formal charge
0calc.
Stereocentres
4calc.
Lipinski rule of five
Passes (0 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(CC2CCC3CNCCC3C2)cc1

c1ccc(CC2CCC3CNCCC3C2)cc1

3 rings, 17 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.

LY 382884 suppliers

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LY 382884 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 LY 382884 is traded under.

HS 2933.49Indicative HS code

Compounds containing in the structure a quinoline or isoquinoline ring-system (whether…

World exports in 2024
$939M
−14.6% vs 2023, imports $1.48B
2019 to 2024
Top exporters
  1. China30.1%
  2. India * partner reported16.7%
  3. Switzerland * partner reported14.1%
Top importers
  1. United Kingdom19.2%
  2. Germany16.0%
  3. Romania8.3%

* Partner reported figures, a lower bound.

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

The HS code shown for LY 382884 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about LY 382884, based on the data on this page

What is LY 382884?

LY382884 is a member of benzoic acids.

What is the CAS number of LY 382884?

The CAS registry number of LY 382884 is 211566-75-5.

What is the molecular formula and weight of LY 382884?

The molecular formula of LY 382884 is C18H23NO4 and its molar mass is 317.39 g/mol.

Is LY 382884 hazardous?

No GHS hazard classification for LY 382884 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 LY 382884?

LY 382884 is usually classified under HS code 293349 (Compounds containing in the structure a quinoline or isoquinoline ring-system (whether…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy LY 382884?

Post a free request on CompoundList and suppliers of LY 382884 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of LY 382884?

Suppliers quote LY 382884 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 LY 382884

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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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