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Steroids and sterols

Orb1706870

Also known as OP-3633?

CAS 2102494-14-2Formula C30H39NO2Molar mass 445.65 g/mol
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Orb1706870 chemical structure, C30H39NO2, CAS 2102494-14-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2102494-14-2
Formula
C30H39NO2
Molar mass
445.65 g/mol
HS code
292250
Category
Steroids and sterols

What is Orb1706870?

Plain description, key identifiers and synonyms

Orb1706870 is a chemical substance with the molecular formula C30H39NO2 and a molar mass of 445.65 g/mol. Its CAS registry number is 2102494-14-2. The IUPAC name is (8S,9R,10R,11S,13S,14S,17S)-11-[4-(dimethylamino)phenyl]-17-hydroxy-10,13-dimethyl-17-prop-1-ynyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(8S,9R,10R,11S,13S,14S,17S)-11-[4-(dimethylamino)phenyl]-17-hydroxy-10,13-dimethyl-17-prop-1-ynyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
CAS number
2102494-14-2
Molecular formula
C30H39NO2
InChIKey
LJUSMSPTDKGAFT-LMNHVJTASA-N
InChI
InChI=1S/C30H39NO2/c1-6-15-30(33)17-14-26-24-12-9-21-18-23(32)13-16-28(21,2)27(24)25(19-29(26,30)3)20-7-10-22(11-8-20)31(4)5/h7-8,10-11,18,24-27,33H,9,12-14,16-17,19H2,1-5H3/t24-,25+,26-,27+,28-,29-,30-/m0/s1
Canonical SMILES
CC#CC1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3C(c3ccc(N(C)C)cc3)CC21C
Isomeric SMILES
CC#C[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C5=CC=C(C=C5)N(C)C)C)O

Synonyms

  • OP-3633?

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
445.65 g/molcalc.
Exact mass
445.2981 Dacalc.
LogP (octanol/water)
5.73calc.
Topological polar surface area
40.54 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
2calc.
Heavy atoms
33calc.
Rings
5calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.63calc.
Formal charge
0calc.
Stereocentres
7calc.
Lipinski rule of five
Passes (1 violation)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=C2CCC3C4CCCC4CC(c4ccccc4)C3C2CC1

O=C1C=C2CCC3C4CCCC4CC(c4ccccc4)C3C2CC1

5 rings, 24 atoms.

1 other chemical 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.

Orb1706870 suppliers

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Orb1706870 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 Orb1706870 is traded under.

HS 2922.50Indicative HS code

Amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function

World exports in 2024
$3.29B
−5.9% vs 2023, imports $3.19B
2019 to 2024
Top exporters
  1. China39.2%
  2. United Kingdom27.1%
  3. India * partner reported4.8%
Top importers
  1. United States20.7%
  2. Germany7.6%
  3. Italy6.6%

* Partner reported figures, a lower bound.

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

The HS code shown for Orb1706870 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb1706870, based on the data on this page

What is Orb1706870?

Orb1706870 is a chemical substance with the molecular formula C30H39NO2 and a molar mass of 445.65 g/mol. Its CAS registry number is 2102494-14-2.

What is the CAS number of Orb1706870?

The CAS registry number of Orb1706870 is 2102494-14-2.

What is the molecular formula and weight of Orb1706870?

The molecular formula of Orb1706870 is C30H39NO2 and its molar mass is 445.65 g/mol.

Is Orb1706870 hazardous?

No GHS hazard classification for Orb1706870 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 Orb1706870?

Orb1706870 is usually classified under HS code 292250 (Amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb1706870?

Post a free request on CompoundList and suppliers of Orb1706870 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb1706870?

Suppliers quote Orb1706870 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 Orb1706870

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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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