1.0 2010-04-08 22:05:50 UTC 2019-11-26 02:59:20 UTC FDB003519 Neochrome Neochrome is a member of the class of compounds known as xanthophylls. Xanthophylls are carotenoids containing an oxygenated carotene backbone. Carotenes are characterized by the presence of two end-groups (mostly cyclohexene rings, but also cyclopentene rings or acyclic groups) linked by a long branched alkyl chain. Carotenes belonging form a subgroup of the carotenoids family. Xanthophylls arise by oxygenation of the carotene backbone. Neochrome is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Neochrome can be found in kiwi, which makes neochrome a potential biomarker for the consumption of this food product. A pre-release version (v0.5) was included with the system disks of the first STs. A proper version 1.0 arrived later, and was bundled with several versions of the ST. Although not officially public domain, this version was often treated as such, and was never actually sold. As a result of this, NEOchrome enjoyed a relatively high level of popularity within the ST community, even in the face of more advanced packages such as DEGAS Elite and Deluxe Paint . 6,7-Didehydro-5b,8b-epoxy-5,5b,6,8b-tetrahydro-b,b-carotene-3,3b,5b-triol Neochrome C40H56O4 600.884 600.417860283 6-[(3E,5Z,7E,9Z,11E,13E,15Z)-16-(6-hydroxy-4,4,7a-trimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-2-yl)-3,7,12-trimethylheptadeca-1,3,5,7,9,11,13,15-octaen-1-ylidene]-1,5,5-trimethylcyclohexane-1,3-diol 6-[(3E,5Z,7E,9Z,11E,13E,15Z)-16-(6-hydroxy-4,4,7a-trimethyl-2,5,6,7-tetrahydro-1-benzofuran-2-yl)-3,7,12-trimethylheptadeca-1,3,5,7,9,11,13,15-octaen-1-ylidene]-1,5,5-trimethylcyclohexane-1,3-diol 25548-02-1 [H]\C(=C(/[H])\C(\[H])=C(/C)C([H])=C([H])C(\[H])=C(\C)C1OC2(C)CC(O)CC(C)(C)C2=C1)\C(\[H])=C(/C)\C(\[H])=C(\[H])/C(/[H])=C(\C)C=C=C1C(C)(C)CC(O)CC1(C)O InChI=1S/C40H56O4/c1-28(17-13-18-30(3)21-22-35-37(5,6)24-32(41)26-39(35,9)43)15-11-12-16-29(2)19-14-20-31(4)34-23-36-38(7,8)25-33(42)27-40(36,10)44-34/h11-21,23,32-34,41-43H,24-27H2,1-10H3/b12-11-,17-13-,19-14+,28-15+,29-16+,30-18+,31-20- ZVKXPPXCNUMUOR-REWZIMNXSA-N belongs to the class of organic compounds known as xanthophylls. These are carotenoids containing an oxygenated carotene backbone. Carotenes are characterized by the presence of two end-groups (mostly cyclohexene rings, but also cyclopentene rings or acyclic groups) linked by a long branched alkyl chain. Carotenes belonging form a subgroup of the carotenoids family. Xanthophylls arise by oxygenation of the carotene backbone. Xanthophylls Organic compounds Lipids and lipid-like molecules Prenol lipids Tetraterpenoids Aliphatic heteropolycyclic compounds Benzofurans Cyclic alcohols and derivatives Dialkyl ethers Dihydrofurans Hydrocarbon derivatives Oxacyclic compounds Secondary alcohols Tertiary alcohols Alcohol Aliphatic heteropolycyclic compound Benzofuran Cyclic alcohol Dialkyl ether Dihydrofuran Ether Hydrocarbon derivative Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Secondary alcohol Tertiary alcohol Xanthophyll logp 7.82 ALOGPS logs -5.82 ALOGPS solubility 9.16e-04 g/l ALOGPS logp 6.42 ChemAxon pka_strongest_acidic 14 ChemAxon pka_strongest_basic -2.7 ChemAxon iupac 6-[(3E,5Z,7E,9Z,11E,13E,15Z)-16-(6-hydroxy-4,4,7a-trimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-2-yl)-3,7,12-trimethylheptadeca-1,3,5,7,9,11,13,15-octaen-1-ylidene]-1,5,5-trimethylcyclohexane-1,3-diol ChemAxon average_mass 600.884 ChemAxon mono_mass 600.417860283 ChemAxon smiles [H]\C(=C(/[H])\C(\[H])=C(/C)C([H])=C([H])C(\[H])=C(\C)C1OC2(C)CC(O)CC(C)(C)C2=C1)\C(\[H])=C(/C)\C(\[H])=C(\[H])/C(/[H])=C(\C)C=C=C1C(C)(C)CC(O)CC1(C)O ChemAxon formula C40H56O4 ChemAxon inchi InChI=1S/C40H56O4/c1-28(17-13-18-30(3)21-22-35-37(5,6)24-32(41)26-39(35,9)43)15-11-12-16-29(2)19-14-20-31(4)34-23-36-38(7,8)25-33(42)27-40(36,10)44-34/h11-21,23,32-34,41-43H,24-27H2,1-10H3/b12-11-,17-13-,19-14+,28-15+,29-16+,30-18+,31-20- ChemAxon inchikey ZVKXPPXCNUMUOR-REWZIMNXSA-N ChemAxon polar_surface_area 69.92 ChemAxon refractivity 193.91 ChemAxon polarizability 73.09 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 85215 Specdb::MsMs 85216 Specdb::MsMs 85217 Specdb::MsMs 147270 Specdb::MsMs 147271 Specdb::MsMs 147272 Kiwi Type 1 specific Actinidia chinensis 3625