N066-0061 Screening compound: [9-(formyloxy)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysen-3a-yl]methyl formate

N066-0061 Screening compound: [9-(formyloxy)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysen-3a-yl]methyl formate
N066-0061 Screening compound: [9-(formyloxy)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysen-3a-yl]methyl formate alternative view

Chemical Structure Depiction of ChemDiv screening compound N066-0061
[9-(formyloxy)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysen-3a-yl]methyl formate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

N066-0061

Molecular Formula

C32H50O4 (C32 H50 O4)

Compound Name

[9-(formyloxy)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysen-3a-yl]methyl formate

IUPAC name

[(5aR5bR11aR)-9-(formyloxy)-5a5b8811a-pentamethyl-1-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysen-3a-yl]methyl formate

SMILES

CC(C)(C(CC1)[C@@](C)(CC2)C(CC3)[C@@]1(C)[C@]1(C)C3C(C(CC3)C(C)=C)C3(COC=O)CC1)C2OC=O

InChI

InChI=1S/C32H50O4/c1-21(2)22-10-15-32(18-35-19-33)17-16-30(6)23(27(22)32)8-9-25-29(5)13-12-26(36-20-34)28(3,4)24(29)11-14-31(25,30)7/h19-20,22-27H,1,8-18H2,2-7H3/t22?,23?,24?,25?,26?,27?,29-,30+,31+,32?/m1/s1

InChI Key

BCJRMIAGIXJFNK-GQIACDMXSA-N

MDL Number (MFCD)

MFCD02939893

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.75

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.603

Distribution Coefficient, logD

6.603

Water Solubility, LogSw

-6.11

Polar Surface Area

43.655

Acid Dissociation Constant (pKa)

27.90

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

10.00

Percent sp3 carbon bonding

87.50

N066-0061 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Steroid-like Compounds (494 compounds)

Natural Compounds Library (353 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cardiovascular
  • Metabolic
  • Immune system
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with N066-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N066-0061?
Check Price and Availability of N066-0061, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of N066-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N066-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N066-0061
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of N066-0061 available by request