Record Information |
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Version | 1.0 |
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Created at | 2022-09-07 23:08:18 UTC |
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Updated at | 2022-09-07 23:08:18 UTC |
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NP-MRD ID | NP0257875 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | (2e,6r)-6-[(1r,3s,3ar,4r,9as,11ar)-3-(acetyloxy)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-7-oxo-1h,2h,3h,4h,5h,5ah,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid |
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Description | Ganoderique acid V belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. It was first documented in 2021 (PMID: 34987491). Based on a literature review a significant number of articles have been published on Ganoderique acid V (PMID: 36034488) (PMID: 36097799) (PMID: 35876760) (PMID: 35159467). |
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Structure | C[C@H](CC\C=C(/C)C(O)=O)[C@H]1C[C@H](OC(C)=O)[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@H]3O InChI=1S/C32H48O6/c1-18(10-9-11-19(2)28(36)37)22-16-26(38-20(3)33)32(8)27-21(12-15-31(22,32)7)30(6)14-13-25(35)29(4,5)24(30)17-23(27)34/h11,18,22-24,26,34H,9-10,12-17H2,1-8H3,(H,36,37)/b19-11+/t18-,22-,23-,24?,26+,30-,31-,32+/m1/s1 |
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Synonyms | Not Available |
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Chemical Formula | C32H48O6 |
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Average Mass | 528.7300 Da |
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Monoisotopic Mass | 528.34509 Da |
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IUPAC Name | (2E,6R)-6-[(2S,9R,11R,12S,14R,15R)-12-(acetyloxy)-9-hydroxy-2,6,6,11,15-pentamethyl-5-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-en-14-yl]-2-methylhept-2-enoic acid |
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Traditional Name | (2E,6R)-6-[(2S,9R,11R,12S,14R,15R)-12-(acetyloxy)-9-hydroxy-2,6,6,11,15-pentamethyl-5-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-en-14-yl]-2-methylhept-2-enoic acid |
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CAS Registry Number | Not Available |
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SMILES | C[C@H](CC\C=C(/C)C(O)=O)[C@H]1C[C@H](OC(C)=O)[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)C1C[C@H]3O |
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InChI Identifier | InChI=1S/C32H48O6/c1-18(10-9-11-19(2)28(36)37)22-16-26(38-20(3)33)32(8)27-21(12-15-31(22,32)7)30(6)14-13-25(35)29(4,5)24(30)17-23(27)34/h11,18,22-24,26,34H,9-10,12-17H2,1-8H3,(H,36,37)/b19-11+/t18-,22-,23-,24?,26+,30-,31-,32+/m1/s1 |
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InChI Key | KUXMNDKEYFTKBS-KIVXMFOGSA-N |
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Experimental Spectra |
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| Not Available | Predicted Spectra |
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| Not Available | Chemical Shift Submissions |
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| Not Available | Species |
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Species of Origin | Not Available |
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Chemical Taxonomy |
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Description | Belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. |
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Kingdom | Organic compounds |
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Super Class | Lipids and lipid-like molecules |
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Class | Prenol lipids |
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Sub Class | Triterpenoids |
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Direct Parent | Triterpenoids |
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Alternative Parents | |
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Substituents | - Triterpenoid
- Monohydroxy bile acid, alcohol, or derivatives
- Hydroxy bile acid, alcohol, or derivatives
- Bile acid, alcohol, or derivatives
- Steroid ester
- Steroid acid
- 14-alpha-methylsteroid
- 7-hydroxysteroid
- Oxosteroid
- Hydroxysteroid
- 3-oxosteroid
- Steroid
- Medium-chain fatty acid
- Hydroxy fatty acid
- Fatty acyl
- Fatty acid
- Unsaturated fatty acid
- Dicarboxylic acid or derivatives
- Cyclic ketone
- Secondary alcohol
- Ketone
- Carboxylic acid ester
- Carboxylic acid
- Carboxylic acid derivative
- Organic oxygen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Carbonyl group
- Alcohol
- Aliphatic homopolycyclic compound
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Molecular Framework | Aliphatic homopolycyclic compounds |
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External Descriptors | Not Available |
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Physical Properties |
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State | Not Available |
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Experimental Properties | Property | Value | Reference |
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Melting Point | Not Available | Not Available | Boiling Point | Not Available | Not Available | Water Solubility | Not Available | Not Available | LogP | Not Available | Not Available |
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Predicted Properties | |
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General References | - Kumar SCS, Raveendran R, Achari KMM: Rapid Preparative Isolation of Cleistanthin A from the Leaves of Cleistanthus Collinus Using Reverse-Phase Flash Chromatography. J Pharm Bioallied Sci. 2022 Apr-Jun;14(2):93-98. doi: 10.4103/jpbs.jpbs_723_21. Epub 2022 Jul 18. [PubMed:36034488 ]
- Samir H, Mahgoub S, Badr JM, El-Gendy A, Hadad GM, Ibrahim EA: A UPLC- MS/MS Method to Quantify beta-Sitosterol and Ferulic Acid of Pygeum Africanum Extract in Bulk and Pharmaceutical Preparation. J Chromatogr Sci. 2023 Aug 19;61(7):619-624. doi: 10.1093/chromsci/bmac077. [PubMed:36097799 ]
- Ma X, Zhai L, Jiang Y, Wang Z, He L, Song F, Wu L: First report of Fusarium oxysporum and Fusarium solani causing root rot on trifoliate orange rootstock in China. Plant Dis. 2022 Jul 25. doi: 10.1094/PDIS-03-22-0694-PDN. [PubMed:35876760 ]
- Zeng X, Zheng Y, He Y, Peng W, Su W: A Rapid LC-MS/MS Method for Simultaneous Determination of Ten Flavonoid Metabolites of Naringin in Rat Urine and Its Application to an Excretion Study. Foods. 2022 Jan 24;11(3):316. doi: 10.3390/foods11030316. [PubMed:35159467 ]
- Okella H, Ikiriza H, Ochwo S, Ajayi CO, Ndekezi C, Nkamwesiga J, Kaggwa B, Aber J, Mtewa AG, Koffi TK, Odongo S, Vertommen D, Kato CD, Ogwang PE: Identification of Antimicrobial Peptides Isolated From the Skin Mucus of African Catfish, Clarias gariepinus (Burchell, 1822). Front Microbiol. 2021 Dec 20;12:794631. doi: 10.3389/fmicb.2021.794631. eCollection 2021. [PubMed:34987491 ]
- LOTUS database [Link]
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