Aflatoxin G2
PubChem CID: 2724362
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | AFLATOXIN G2, 7241-98-7, Dihydroaflatoxin G1, UNII-2MS0D8WA29, 2MS0D8WA29, CCRIS 4936, HSDB 3456, EINECS 230-643-4, AFLATOXIN G2 [MI], AFLATOXIN G2 [HSDB], DTXSID80891796, Aflatoxin G2 0.5 microg/mL in Acetonitrile, (7aR-cis)-3,4,7a,9,10,10a-hexahydro-5-methoxy-1H,12H-Furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c][1]benzopyran-1,12-dione, 1H,12H-Furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)(1)benzopyran-1,12-dione,3,4,7aalpha,9,10,10aalpha-hexahydro-5-methoxy-, 3,4,7aalpha,9,10,10aalpha-Hexahydro-5-methoxy-1H,12H-furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)(1)-benzopyran-1,12-dione, (3S,7R)-11-methoxy-6,8,16,20-tetraoxapentacyclo[10.8.0.02,9.03,7.013,18]icosa-1,9,11,13(18)-tetraene-17,19-dione, (7AR,cis)3,4,7a,9,10,10a-hexahydro-5-methoxy-1H,12H-furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)chromene-1,12-dione, (7aR,cis)3,4,7a,9,10,10a-hexahydro-5-methoxy-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromene-1,12-dione, 1H,12H-Furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)(1)benzopyran-1,12-dione, 3,4,7a,9,10,10a-hexahydro-5-methoxy-, (7aR,10aS)-, 1H,12H-Furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)(1)benzopyran-1,12-dione, 3,4,7a-alpha,9,10,10a-alpha-hexahydro-5-methoxy-, (3S,7R)-11-methoxy-6,8,16,20-tetraoxapentacyclo(10.8.0.02,9.03,7.013,18)icosa-1,9,11,13(18)-tetraene-17,19-dione, 1H,12H-FURO(3',2':4,5)FURO(2,3-H)PYRANO(3,4-C)(1)BENZOPYRAN-1,12-DIONE, 3,4,7A.ALPHA.,9,10,10A.ALPHA.-HEXAHYDRO-5-METHOXY-, 1H,12H-FURO(3',2':4,5)FURO(2,3-H)PYRANO(3,4-C)(1)BENZOPYRAN-1,12-DIONE, 3,4,7AALPHA,9,10,10AALPHA-HEXAHYDRO-5-METHOXY-, 1H,12H-Furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c][1]benzopyran-1,12-dione, 3,4,7a.alpha.,9,10,10a.alpha.-hexahydro-5-methoxy-, 1H,12H-Furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c][1]benzopyran-1,12-dione, 3,4,7aalpha,9,10,10aalpha-hexahydro-5-methoxy-, 3,4,7aa,9,10,10aa-Hexahydro-5-methoxy-1H,12H-furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)(l)-benzopyran-1,12-dione, 3,4,7aa,9,10,10aa-Hexahydro-5-methoxy-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c][l]-benzopyran-1,12-dione, MFCD00078141, Aflatoxin G2 in Acetonitrile, CHEBI:80705, Aflatoxin G2, reference material, MSK7208, WPCVRWVBBXIRMA-WNWIJWBNSA-N, DTXCID301031033, 11-methoxy-6,8,16,20-tetraoxapentacyclo(10.8.0.0^(2,9).0^(3,7).0^(13,18))icosa-1,9,11,13(18)-tetraene-17,19-dione, 11-methoxy-6,8,16,20-tetraoxapentacyclo[10.8.0.0^{2,9}.0^{3,7}.0^{13,18}]icosa-1,9,11,13(18)-tetraene-17,19-dione, EX-A4123, HY-N6698, MSK7208-100A, FA17235, (7aR,10aS)-3,4,7a,9,10,10a-Hexahydro-5-methoxy-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c][1]benzopyran-1,12-dione, 1H,12H-Furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c][1]benzopyran-1,12-dione, 3,4,7a,9,10,10a-hexahydro-5-, DA-70628, CS-0099736, C16754, G12272, Aflatoxin G2 solution in Acetonitrile, 100ug/mL, Q26841280, (7aR,10aS)-3,4,7a,9,10,10a-Hexahydro-5-methoxy-1H,12H-furo, 1H,12H-FURO(3',2':4,5)FURO(2,3-H)PYRANO(3,4-C)(1)BENZOPYRAN-1,12-DIONE,, (7aR,10aS)-5-Methoxy-3,4,7a,9,10,10a-hexahydro-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromene-1,12-dione, (7AR,CIS)3,4,7A,9,10,10A-HEXAHYDRO-5-METHOXY-1H,12H- FURO(3',2':4,5)FURO(2,3-H)PYRANO(3,4-C)CHROMENE-1,12-DIONE, 1H,12H-FURO(3',2':4,5)FURO(2,3-H)PYRANO(3,4-C)(1)BENZOPYRAN- 1,12-DIONE, 3,4,7A,9,10,10A-HEXAHYDRO-5-METHOXY-, (7AR,10AS)-, 1H,12H-Furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)(1)benzopyran-1,12-dione, 3,4,7a,9,10,10a-hexahydro-5-methoxy-, (7aR-10aS)-, 1H,12HFuro(3',2':4,5)furo(2,3h)pyrano(3,4c)(1)benzopyran1,12dione,3,4,7aalpha,9,10,10aalphahexahydro5methoxy, 3,4,7aalpha,9,10,10aalpha-Hexahydro-5-methoxy-1H,12H-furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)(1)benzopyrano-1,12-dione, 3,4,7aalpha,9,10,10aalphaHexahydro5methoxy1H,12Hfuro(3',2':4,5)furo(2,3h)pyrano(3,4c)(1)benzopyran1,12dione |
|---|---|
| Topological Polar Surface Area | 80.3 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 24.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 626.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Iupac Name | (3S,7R)-11-methoxy-6,8,16,20-tetraoxapentacyclo[10.8.0.02,9.03,7.013,18]icosa-1,9,11,13(18)-tetraene-17,19-dione |
| Prediction Hob | 1.0 |
| Xlogp | 1.5 |
| Molecular Formula | C17H14O7 |
| Prediction Swissadme | 1.0 |
| Inchi Key | WPCVRWVBBXIRMA-WNWIJWBNSA-N |
| Fcsp3 | 0.4117647058823529 |
| Logs | -4.633 |
| Rotatable Bond Count | 1.0 |
| Logd | 1.653 |
| Compound Name | Aflatoxin G2 |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 330.074 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 330.074 |
| Hydrogen Bond Acceptor Count | 7.0 |
| Molecular Weight | 330.29 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.7538437333333343 |
| Inchi | InChI=1S/C17H14O7/c1-20-9-6-10-12(8-3-5-22-17(8)23-10)14-11(9)7-2-4-21-15(18)13(7)16(19)24-14/h6,8,17H,2-5H2,1H3/t8-,17+/m0/s1 |
| Smiles | COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4[C@@H]5CCO[C@@H]5OC4=C1 |
| Nring | 5.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Ficus Carica (Plant) Rel Props:Source_db:cmaup_ingredients