Found 57 results

Search term: MF = 'C_{37}H_{58}O_{11}'
ChemSpider 2D Image | (3beta,9beta,15alpha,16beta,24S)-15,16,25-Trihydroxy-3-(pentopyranosyloxy)-16,23-epoxy-9,19-cyclolanost-7-en-24-yl acetate | C37H58O11

(3β,9β,15α,16β,24S)-15,16,25-Trihydroxy-3-(pentopyranosyloxy)-16,23-epoxy-9,19-cyclolanost-7-en-24-yl acetate

  • Molecular FormulaC37H58O11
  • Average mass678.850 Da
  • Monoisotopic mass678.397888 Da
  • ChemSpider ID353844

  • defined stereocentres - 11 of 16 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3β,9β,15α,16β,24S)-15,16,25-Trihydroxy-3-(pentopyranosyloxy)-16,23-epoxy-9,19-cyclolanost-7-en-24-yl acetate [ACD/IUPAC Name]
(3β,9β,15α,16β,24S)-15,16,25-Trihydroxy-3-(pentopyranosyloxy)-16,23-epoxy-9,19-cyclolanost-7-en-24-yl-acetat [German] [ACD/IUPAC Name]
Acétate de (3β,9β,15α,16β,24S)-15,16,25-trihydroxy-3-(pentopyranosyloxy)-16,23-époxy-9,19-cyclolanost-7-én-24-yle [French] [ACD/IUPAC Name]
Pentopyranoside, (3β,9β,15α,16β,24S)-24-(acetyloxy)-16,23-epoxy-15,16,25-trihydroxy-9,19-cyclolanost-7-en-3-yl [ACD/Index Name]
(24S)-24-O-acetyl,-7,8-didehydroshengmanol xyloside

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

NCI60_038673 [DBID]
NSC709753 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 798.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.4 mmHg at 25°C
Enthalpy of Vaporization: 132.2±6.0 kJ/mol
Flash Point: 242.5±26.4 °C
Index of Refraction: 1.606
Molar Refractivity: 174.9±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 3.32
ACD/BCF (pH 5.5): 196.17
ACD/KOC (pH 5.5): 1522.89
ACD/LogD (pH 7.4): 3.32
ACD/BCF (pH 7.4): 196.16
ACD/KOC (pH 7.4): 1522.87
Polar Surface Area: 175 Å2
Polarizability: 69.3±0.5 10-24cm3
Surface Tension: 63.3±5.0 dyne/cm
Molar Volume: 506.9±5.0 cm3

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