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Amino acids and derivatives

Orb1703379

Also known as (2-(3-(Hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl)ethyl)-L-phenylalanine, (2S)-2-[2-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]ethylamino]-3-phenylpropanoic acid

CAS 2002363-68-8Formula C23H23N3O3Molar mass 389.46 g/mol
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Orb1703379 chemical structure, C23H23N3O3, CAS 2002363-68-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2002363-68-8
Formula
C23H23N3O3
Molar mass
389.46 g/mol
HS code
293399
Category
Amino acids and derivatives

What is Orb1703379?

Plain description, key identifiers and synonyms

Orb1703379 is a chemical substance with the molecular formula C23H23N3O3 and a molar mass of 389.46 g/mol. Its CAS registry number is 2002363-68-8. The IUPAC name is (2S)-2-[2-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]ethylamino]-3-phenylpropanoic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S)-2-[2-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]ethylamino]-3-phenylpropanoic acid
CAS number
2002363-68-8
Molecular formula
C23H23N3O3
InChIKey
MPXJMOWWFQFYEP-NRFANRHFSA-N
InChI
InChI=1S/C23H23N3O3/c27-14-16-13-18-17-8-4-5-9-19(17)26-22(18)20(25-16)10-11-24-21(23(28)29)12-15-6-2-1-3-7-15/h1-9,13,21,24,26-27H,10-12,14H2,(H,28,29)/t21-/m0/s1
Canonical SMILES
O=C(O)C(Cc1ccccc1)NCCc1nc(CO)cc2c1[nH]c1ccccc12
Isomeric SMILES
C1=CC=C(C=C1)C[C@@H](C(=O)O)NCCC2=NC(=CC3=C2NC4=CC=CC=C43)CO

Synonyms

  • (2-(3-(Hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl)ethyl)-L-phenylalanine
  • (2S)-2-[2-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]ethylamino]-3-phenylpropanoic 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
389.46 g/molcalc.
Exact mass
389.1739 Dacalc.
LogP (octanol/water)
3.04calc.
Topological polar surface area
98.24 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
8calc.
Heavy atoms
29calc.
Rings
4calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.22calc.
Formal charge
0calc.
Stereocentres
1calc.
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(CCNCCc2nccc3c2[nH]c2ccccc23)cc1

c1ccc(CCNCCc2nccc3c2[nH]c2ccccc23)cc1

4 rings, 24 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.

Orb1703379 suppliers

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Orb1703379 price

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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 Orb1703379 is traded under.

HS 2933.99Indicative HS code

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

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

The HS code shown for Orb1703379 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb1703379, based on the data on this page

What is Orb1703379?

Orb1703379 is a chemical substance with the molecular formula C23H23N3O3 and a molar mass of 389.46 g/mol. Its CAS registry number is 2002363-68-8. The IUPAC name is (2S)-2-[2-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]ethylamino]-3-phenylpropanoic acid.

What is the CAS number of Orb1703379?

The CAS registry number of Orb1703379 is 2002363-68-8.

What is the molecular formula and weight of Orb1703379?

The molecular formula of Orb1703379 is C23H23N3O3 and its molar mass is 389.46 g/mol.

Is Orb1703379 hazardous?

No GHS hazard classification for Orb1703379 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 Orb1703379?

Orb1703379 is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb1703379?

Post a free request on CompoundList and suppliers of Orb1703379 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb1703379?

Suppliers quote Orb1703379 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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