2-[4-(3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid

CAS: 2044276-17-5

Molecular Formula	`C26H43NO5`
Molecular Weight	449.6 g/mol
LogP	4.3
Topological Polar Surface Area	107.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	449.31412
Heavy Atoms	32
Complexity	727.0

Chemical Identifiers

CAS Number	2044276-17-5
SMILES	`CC(CCC(=O)NCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C`
InChIKey	`GHCZAUBVMUEKKP-UHFFFAOYSA-N`

📖 Product Overview

2-[4-(3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid (CAS: 2044276-17-5) is a chemical compound with molecular formula C26H43NO5 and molecular weight 449.6 g/mol. Its IUPAC systematic name is 2-[4-(3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid. LogP 4.3 Topological Polar Surface Area 107.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 449.31412 Heavy Atoms 32 Complexity 727.0 InChI Key: GHCZAUBVMUEKKP-UHFFFAOYSA-N. SMILES: CC(CCC(=O)NCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for 2-[4-(3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid.

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