Cas no 120462-51-3 (Nimbanal)
Nimbanal structure
Product Name:Nimbanal
CAS No:120462-51-3
MF:C29H34O8
MW:510.575469493866
CID:209147
PubChem ID:14194023
Update Time:2025-04-19
Nimbanal Chemical and Physical Properties
Names and Identifiers
-
- 2H-Cyclopenta[b]naphtho[2,3-d]furan-10-aceticacid,5-(acetyloxy)-6-formyl-2-(3-furanyl)-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-1,6,9a,10a-tetramethyl-9-oxo-,methyl ester, (2R,3aR,4aS,5R,5aS,6R,9aR,10S,10aR)-
- Nimbanal
- 2H-Cyclopenta[b]naphtho[2,3-d]furan-10-aceticacid,5-(acetyloxy)-6-formyl-2-(3-furanyl)-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-1
- 2H-Cyclopenta[b]naphtho[2,3-d]furan-10-aceticacid,5-(acetyloxy)-6-formyl-2-(3-furanyl)-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-1,6,9a,10a-tetramethyl-9-oxo-,methyl ester, (2R,3aR,4aS,5R,5aS,6R,9aR,10S,10
- NIMBANAL,OFF-WHITE SOLID
- (+)-Nimbanal
- 24-Nor-12,13-secochola-2,13,20,22-tetraen-12-oicacid, 6-(acetyloxy)-7,15:21,23-diepoxy-4-formyl-4,8-dimethyl-1-oxo-, methylester, (4a,5a,6a,7a,15b,17a)-
- (4α,5α,6α,7α,15β,17α)-6-(Acetyloxy)-7,15:21,23-diepoxy-4-forMyl-4,8-diMethyl-1-oxo-24-nor-12,13-secochola-2,13,20,22-tetraen-12-oic Acid Methyl Ester
- (2R,3aR,4aS,5R,5aS,6R,9aR,10S,10aR)-5-(Acetyloxy)-6-forMyl-2-(3-furanyl)-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-1,6,9a,10a-tetraMethyl-9-oxo-2H-cyclopenta[b]naphtho[2,3-d]furan-10-acetic Acid Methyl Ester
- methyl 2-[(1S,2R,3S,4R,8R,9S,10R,13R,15R)-2-acetyloxy-4-formyl-13-(furan-3-yl)-4,8,10,12-tetramethyl-7-oxo-16-oxatetracyclo[8.6.0.03,8.011,15]hexadeca-5,11-dien-9-yl]acetate
- 120462-51-3
- DTXSID20557187
- Methyl [(2R,3aR,4aS,5R,5aS,9aR,10S,10aR)-5-(acetyloxy)-6-formyl-2-(furan-3-yl)-1,6,9a,10a-tetramethyl-9-oxo-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-2H-cyclopenta[b]naphtho[2,3-d]furan-10-yl]acetate
- J-004349
- SCHEMBL22091576
- methyl 2-((1S,2R,3S,4R,8R,9S,10R,13R,15R)-2-acetyloxy-4-formyl-13-(furan-3-yl)-4,8,10,12-tetramethyl-7-oxo-16-oxatetracyclo(8.6.0.03,8.011,15)hexadeca-5,11-dien-9-yl)acetate
-
- Inchi： 1S/C29H34O8/c1-15-18(17-8-10-35-13-17)11-19-23(15)29(5)20(12-22(33)34-6)28(4)21(32)7-9-27(3,14-30)25(28)24(26(29)37-19)36-16(2)31/h7-10,13-14,18-20,24-26H,11-12H2,1-6H3/t18-,19-,20-,24-,25+,26-,27+,28+,29-/m1/s1
- InChI Key： KTZMJZLZKQMODA-AGKCECBESA-N
- SMILES： O1[C@@H]2C[C@@H](C3=COC=C3)C(C)=C2[C@]2(C)[C@H]1[C@@H]([C@H]1[C@@](C=O)(C)C=CC([C@]1(C)[C@H]2CC(=O)OC)=O)OC(C)=O
Computed Properties
- Exact Mass: 510.22500
- Monoisotopic Mass: 510.22536804g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 37
- Rotatable Bond Count: 7
- Complexity: 1090
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 9
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 109?2
Experimental Properties
- PSA: 109.11000
- LogP: 3.94830
Nimbanal Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | N476210-1mg |
Nimbanal |
120462-51-3 | 1mg |
$ 129.00 | 2023-09-06 | ||
| TRC | N476210-2 mg |
Nimbanal |
120462-51-3 | 2mg |
185.00 | 2021-07-23 | ||
| TRC | N476210-2.5 mg |
Nimbanal |
120462-51-3 | 2.5 mg |
215.00 | 2021-07-23 | ||
| TRC | N476210-5 mg |
Nimbanal |
120462-51-3 | 5mg |
400.00 | 2021-07-23 | ||
| TRC | N476210-10 mg |
Nimbanal |
120462-51-3 | 10mg |
760.00 | 2021-07-23 | ||
| TRC | N476210-25 mg |
Nimbanal |
120462-51-3 | 25mg |
1695.00 | 2021-07-23 | ||
| TRC | N476210-2mg |
Nimbanal |
120462-51-3 | 2mg |
$230.00 | 2023-05-17 | ||
| TRC | N476210-2.5mg |
Nimbanal |
120462-51-3 | 2.5mg |
$265.00 | 2023-05-17 | ||
| TRC | N476210-5mg |
Nimbanal |
120462-51-3 | 5mg |
$488.00 | 2023-05-17 | ||
| TRC | N476210-10mg |
Nimbanal |
120462-51-3 | 10mg |
$930.00 | 2023-05-17 |
Nimbanal Related Literature
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
120462-51-3 (Nimbanal) Related Products
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