Menatetrenone
PubChem CID: 5282367
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| Compound Synonyms | menatetrenone, Menaquinone-4, 863-61-6, Menaquinone 4, 11032-49-8, Kaytwo, Kefton-2, Menatetrenona, Vitamin MK 4, Menaquinone K4, vitamin K2(20), Menatetrenonum, MENATETRANONE, Kaytwo n, Vitamin K2(sub 20), Menatetrenone [INN:JAN], Menatetrenonum [INN-Latin], K2(sub 20), 6041-00-5, Menatetrenona [INN-Spanish], 2-methyl-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]naphthalene-1,4-dione, 2-Methyl-3-trans-tetraprenyl-1,4-naphthoquinone, menaquinone(4), 2-Methyl-3-geranylgeranyl-1,4-naphthoquinone, MK-4, DTXSID6048969, CHEBI:78277, E3100, MFCD00079646, MENATETRENONE [INN], MENATETRENONE [JAN], MENAQUINONE 4 [MI], MENATETRENONE [MART.], 2-Methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-1,4-naphthoquinone, MENATETRENONE [WHO-DD], MLS000028742, 2-Methyl-3-((2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl)naphthalene-1,4-dione, 27Y876D139, DTXCID3028895, MENAQUINONE-4 [USP-RS], 2-Methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-1,4-naphthochinon, 1,4-Naphthalenedione, 2-methyl-3-((2E,6E,10E)3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-, 1,4-Naphthalenedione, 2-Methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-, (E,E,E)-, SMR000058955, Menaquinone 4(Mixture of cis-trans isomers), Menatetrenonum (INN-Latin), 1,4-Naphthalenedione, 2-methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-, Menatetrenona (INN-Spanish), MENATETRENONE (MART.), MENAQUINONE-4 (USP-RS), MK4, vitamin MK-4, 2-methyl-3-((2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl)naphthalene-1,4-dione, 2-methyl-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]-1,4-naphthoquinone, (E,E,E)-isomer of menatetrenone, 2-Methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetrenyl)-1,4-naphthoquinone, Glakay, Vitamin K2(MK-4), Menaquinone K4, UNII-27Y876D139, NCGC00183125-01, 2-Methyl-3-((2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl)-1,4-naphthoquinone, Menaquinone (K2), 2-methyl-3-all-trans-tetraprenyl-1,4-naphthoquinone, 6Z-Vitamin K2, Vitamin K2 (TN), Opera_ID_148, 2-Methyl-3-tetraprenyl-1,4-naphthoquinone, Menadione sodium bisulfite, Vitamin K3 sodium bisulfite, Menaquinone-4 (Standard), 6Z-Vitamin K2(20), Vitamin K2 pound MK-7), DSSTox_CID_28895, DSSTox_RID_80857, Menatetrenone (JP18/INN), DSSTox_GSID_45406, SCHEMBL434553, SCHEMBL571912, CHEMBL259223, MQ-4, EX-A5474A, HY-B2156R, DKHGMERMDICWDU-GHDNBGIDSA-N, HMS2230J06, Ea-0167, HY-B2156, Tox21_110567, Tox21_113413, BDBM50423776, MSK160175, s5082, AKOS025311021, AKOS037645019, Menaquinone (K2), analytical standard, CCG-269176, DB12148, FM25052, 2-Methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-1,4-naphthalenedione, NCGC00181325-01, NCGC00181325-03, AS-17910, AS-56161, CAS-863-61-6, DA-75412, 1ST160175, CS-0020307, M2398, NS00069524, D00100, E-0167, Q192354, BRD-K75864342-001-14-2, 2-Methyl-3-geranylgeranyl-1,4-naphthoqui none, Glakay, Vitamin K2, 1,4-Naphthalenedione, 2-methyl-3-[(2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]- |
|---|---|
| Topological Polar Surface Area | 34.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 33.0 |
| Description | Inhibits bone resorption via PGE2 synthesis inhibition and other mechanisms. Antihaemorrhagic vitamin [CCD] Menatetrenone (MK4), is a menaquinone compound used as a hemostatic agent and as adjunctive therapy for the pain of osteoporosis. It is marketed for the latter indication in Japan by Eisai Co., under the trade name Glakay. Menatetrenone is one of the nine forms of vitamin K2. [Wikipedia]. Menatetrenone is found in many foods, some of which are painted comber, pizza, common bean, and cheese. |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 855.0 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P38435, P25779, P10636, Q962Y6, Q9F4F7, O97447, P28482, Q96KQ7, Q9UIF8, Q96QE3, P11473, O95149, O89049, Q9UNA4, P84022, Q9NUW8, Q03431, P27695, O95398, n.a., P0DTD1, P37840 |
| Iupac Name | 2-methyl-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]naphthalene-1,4-dione |
| Prediction Hob | 0.0 |
| Class | Prenol lipids |
| Target Id | NPT51, NPT282, NPT920 |
| Xlogp | 8.9 |
| Superclass | Lipids and lipid-like molecules |
| Subclass | Quinone and hydroquinone lipids |
| Molecular Formula | C31H40O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | DKHGMERMDICWDU-GHDNBGIDSA-N |
| Fcsp3 | 0.4193548387096774 |
| Logs | -4.528 |
| Rotatable Bond Count | 11.0 |
| State | Solid |
| Logd | 5.519 |
| Synonyms | 2-Methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-1,4-naphthalenedione, 9CI, Glakay, Kaytwo, Keivitan 2, Menaquinone-4, Menartu, Menatetren, MK4, Sawa K, Tohmittel, Two-VK, 2-Methyl-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-1,4-naphthoquinone, 2-Methyl-3-geranylgeranyl-1,4-naphthoquinone, 2-Methyl-3-trans-tetraprenyl-1,4-naphthoquinone, Menaquinone 4, Menaquinone K4, Menatetrenona, Menatetrenonum, MK-4, Vitamin K2, Vitamin MK 4, 2-Methyl-3-all-trans-tetraprenyl-1,4-naphthoquinone, Vitamin K2(20), Kefton-2, (e,e,e)-Isomer OF menatetrenone, Vitamin MK-4, Menaquinones, Vitamin K quinone, Vitamin K 2, Menaquinone, Lycium substance b |
| Compound Name | Menatetrenone |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 444.303 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 444.303 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 444.6 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 3.0 |
| Molecular Framework | Aromatic homopolycyclic compounds |
| Esol | -7.631331254545455 |
| Inchi | InChI=1S/C31H40O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,12,14,16,18-20H,9-11,13,15,17,21H2,1-6H3/b23-14+,24-16+,25-20+ |
| Smiles | CC1=C(C(=O)C2=CC=CC=C2C1=O)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 3.0 |
| Taxonomy Direct Parent | Menaquinones |
- 1. Outgoing r'ship
FOUND_INto/from Amorpha Fruticosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Chenopodium Quinoa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Linum Usitatissimum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Panicum Miliaceum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Sorghum Bicolor (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all