Cas no 1154518-97-4 (Sootepin D)
Sootepin D structure
Product Name:Sootepin D
CAS No:1154518-97-4
MF:C31H48O4
MW:484.710430145264
CID:97742
PubChem ID:44179869
Update Time:2025-04-18
Sootepin D Chemical and Physical Properties
Names and Identifiers
-
- 1H-Cyclopenta[a]cyclopropa[e]naphthalene-3a(4H)-propanoicacid,7-[(1R,4E)-1,5-dimethyl-6-oxo-4-hexen-1-yl]decahydro-3-[1-(hydroxymethyl)ethenyl]-6a,9a-dimethyl-,methyl ester, (3R,3aR,4aS,6aR,7R,9aS,9bS)-
- Sootepin D
- 1H-Cyclopenta[a]cyclopropa[e]naphthalene-3a(4H)-propanoicacid,7-[(1R,4E)-1,5-dimethyl-6-oxo-4-...
- 1H-Cyclopenta[a]cyclopropa[e]naphthalene-3a(4H)-propanoicacid,7-[(1R,4E)-1,5-dimethyl-6-oxo-4-hexen-1-yl]decahydro-3-[1-(hydr
- 1H-Cyclopenta[a]cyclopropa[e]naphthalene-3a(4H)-propanoicacid,7-[(1R,4E)-1,5-dimethyl-6-oxo-4-hexen-1-yl]decahydro-3-[1-(hydroxymethyl)ethenyl]-6a,9a-dimethyl-,methyl ester, (3R,3aR,4aS,6aR,7R,9aS,9bS
- Methyl 3-[(1R,3aS,3bS,6R,6aR,7aS,9aR)-6-(3-hydroxy-1-propen-2-yl) -3a,9a-dimethyl-1-[(2R,5E)-6-methyl-7-oxo-5-hepten-2-yl]decahydro -1H-cyclopenta[a]cyclopropa[e]naphthalen-6a(7H)-yl]propanoate
- [ "" ]
- AKOS037514515
- methyl 3-[(1S,4R,5R,8S,9S,12R,13R)-12-(3-hydroxyprop-1-en-2-yl)-4,8-dimethyl-5-[(E,2R)-6-methyl-7-oxohept-5-en-2-yl]-13-tetracyclo[7.5.0.01,13.04,8]tetradecanyl]propanoate
- CHEMBL552070
- FS-10177
- CS-0086237
- 1154518-97-4
- HY-122521
- (+)-Sootepin D
- methyl 3-((1S,4R,5R,8S,9S,12R,13R)-12-(3-hydroxyprop-1-en-2-yl)-4,8-dimethyl-5-((E,2R)-6-methyl-7-oxohept-5-en-2-yl)-13-tetracyclo(7.5.0.01,13.04,8)tetradecanyl)propanoate
-
- Inchi： 1S/C31H48O4/c1-21(18-32)8-7-9-22(2)24-12-14-29(5)26-11-10-25(23(3)19-33)30(15-13-27(34)35-6)20-31(26,30)17-16-28(24,29)4/h8,18,22,24-26,33H,3,7,9-17,19-20H2,1-2,4-6H3/b21-8+/t22-,24-,25+,26+,28-,29+,30-,31+/m1/s1
- InChI Key： ILOHMDKQENYFEG-YSIJHDMVSA-N
- SMILES： OCC(=C)[C@@H]1CC[C@H]2[C@]3(C)CC[C@H]([C@H](C)CC/C=C(/C=O)\C)[C@@]3(C)CC[C@@]32C[C@@]31CCC(=O)OC
Computed Properties
- Exact Mass: 484.35500
- Monoisotopic Mass: 484.355
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 35
- Rotatable Bond Count: 11
- Complexity: 890
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 8
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 63.6A^2
- XLogP3: 7.5
Experimental Properties
- Color/Form: Oil
- Density: 1.1±0.1 g/cm3
- Boiling Point: 574.2±20.0 °C at 760 mmHg
- Flash Point: 175.7±15.3 °C
- PSA: 63.60000
- LogP: 6.66870
- Vapor Pressure: 0.0±3.6 mmHg at 25°C
Sootepin D Security Information
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：Store at 4 ℃, better at -4 ℃
Sootepin D Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | S22810-5mg |
Methyl 3-[(1R,3aS,3bS,6R,6aR,7aS,9aR)-6-(3-hydroxy-1-propen-2-yl) -3a,9a-dimethyl-1-[(2R,5E)-6-methyl-7-oxo-5-hepten-2-yl]decahydro -1H-cyclopenta[a]cyclopropa[e]naphthalen-6a(7H)-yl]propanoate |
1154518-97-4 | 5mg |
￥5600.0 | 2021-09-07 | ||
| A2B Chem LLC | AE17578-500mg |
Sootepin D |
1154518-97-4 | 98% by HPLC | 500mg |
$27058.00 | 2024-04-20 | |
| A2B Chem LLC | AE17578-1000mg |
Sootepin D |
1154518-97-4 | 98% by HPLC | 1000mg |
$43277.00 | 2024-04-20 | |
| A2B Chem LLC | AE17578-5mg |
Sootepin D |
1154518-97-4 | 98% by HPLC | 5mg |
$830.00 | 2024-04-20 | |
| A2B Chem LLC | AE17578-10mg |
Sootepin D |
1154518-97-4 | 98% by HPLC | 10mg |
$1379.00 | 2024-04-20 | |
| A2B Chem LLC | AE17578-25mg |
Sootepin D |
1154518-97-4 | 98% by HPLC | 25mg |
$2875.00 | 2024-04-20 | |
| A2B Chem LLC | AE17578-50mg |
Sootepin D |
1154518-97-4 | 98% by HPLC | 50mg |
$4873.00 | 2024-04-20 | |
| A2B Chem LLC | AE17578-100mg |
Sootepin D |
1154518-97-4 | 98% by HPLC | 100mg |
$8405.00 | 2024-04-20 |
Sootepin D Related Literature
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
-
Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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