Balsaminol A (original) (raw)
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Balsaminol A
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| Names | |
| IUPAC name (23_R_)-9-Methyl-19-nor-9β,10α-lanosta-5,24-diene-3β,7β,23,29-tetrol | |
| Systematic IUPAC name (1_R_,3a_S_,3b_R_,4_S_,6_S_,7_S_,9a_S_,9b_S_,11a_R_)-6-(Hydroxymethyl)-1-[(2_R_,4_R_)-4-hydroxy-6-methylhept-5-en-2-yl]-3a,6,9b,11a-tetramethyl-2,3,3a,3b,4,6,7,8,9,9a,9b,10,11,11a-tetradecahydro-1_H_-cyclopenta[_a_]phenanthrene-4,7-diol | |
| Other namesCucurbita-5,24-diene-3β,7β,23(R),29-tetraol; (3β,4β,7β,9β,10α,23_R_)-4-(Hydroxymethyl)-4,9,14-trimethyl-19-norcholesta-5,24-diene-3,7,23-triol | |
| Identifiers | |
| CAS Number | 1189131-51-8  Y |
| 3D model (JSmol) | Interactive imageInteractive image |
| ChEMBL | ChEMBL1078436 Y |
| ChemSpider | 24655824 Y |
| PubChem CID | 44607276 |
| UNII | XN2W8NF8BB Y |
| CompTox Dashboard (EPA) | DTXSID30659646  |
| InChI InChI=1S/C30H50O4/c1-18(2)14-20(32)15-19(3)21-10-11-30(7)26-24(33)16-23-22(8-9-25(34)28(23,5)17-31)27(26,4)12-13-29(21,30)6/h14,16,19-22,24-26,31-34H,8-13,15,17H2,1-7H3/t19-,20+,21-,22-,24+,25+,26-,27+,28-,29-,30+/m1/s1 YKey: AVFNYXHRDYAHNF-HEVJPHJFSA-N Y |
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| SMILES C[C@H](C[C@@H](O)/C=C(C)/C)[C@@]1([H])CC[C@@]2(C)[C@]3([H])[C@@H](O)C=C4[C@@](C)(CO)[C@@H](O)CC[C@@]4([H])[C@]3(C)CC[C@@]21CC[C@H](C[C@H](C=C(C)C)O)[C@H]1CC[C@@]2([C@@]1(CC[C@@]3([C@H]2[C@H](C=C4[C@H]3CC[C@@H]([C@]4(C)CO)O)O)C)C)C | |
| Properties | |
| Chemical formula | C30H50O4 |
| Molar mass | 474.726 g·mol−1 |
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).  Y verify (what is Y N ?) Infobox references |
Chemical compound
Balsaminol A or cucurbita-5,24-diene-3β,7β,23(R),29-tetraol, is a chemical compound with formula C
30H
50O
4, found in the Balsam apple vine (Momordica balsamina). It is a cucurbitane-type triterpenoid, related to cucurbitacin, isolated by C. Ramalhete and others in 2009.[1]
Balsaminol A is an amorphous powder soluble in methanol and ethyl acetate but insoluble in _n_-hexane. It is cytotoxic at about 50 μM.[1]
- ^ a b Cátia Ramalhete; Tayyab A. Mansoor; Silva Mulhovo; Joseph Molnár & Maria-José U. Ferreira (2009). "Cucurbitane-Type Triterpenoids from the African Plant Momordica balsamina". Journal of Natural Products. 72 (11): 2009–2013. doi:10.1021/np900457u. hdl:10884/1322. PMID 19795842.