Basic information
- CAS
24568-67-0- Standard SMILES
COc1c(O)c2c(=O)cc(OC)c3c4c(OC)cc(=O)c5c(O)c(OC)c6c(c(c1C(C(C)=O)C6C(C)=O)c23)c54- InChIKey
SVDUCZIGPIYIHQ-UHFFFAOYSA-N- Molecular formula
- C30H24O10
- Average molar mass
- 544.5 g/mol
- Monoisotopic mass
- 544.13694696
Overview
Elsinochrome A is a naphthalenone.
Names & identifiers
- Preferred name
- Elsinochroma
- IUPAC
- 12,13-diacetyl-9,16-dihydroxy-5,10,15,20-tetramethoxyhexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4(21),5,9,15,17(22),19-nonaene-7,18-dione
- English name
- elsinochrome A
- Molecular formula
- C30H24O10
- Molecular weight
- 544.51
Names & synonyms
Elsinochrome A12,13-Diacetyl-9,16-dihydroxy-5,10,15,20-tetramethoxyhexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4(21),5,9,15,17(22),19-nonaene-7,18-dioneelsinochromaElsinochrome A (7CI, 8CI)SCHEMBL29404988DTXSID90947435CHEBI:201830(12R,13R)-12,13-diacetyl-9,16-dihydroxy-5,10,15,20-tetramethoxyhexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4(21),5,9,15,17(22),19-nonaene-7,18-dioneNSC623609NSC-6236091,2-Diacetyl-5,10-dihydroxy-3,7,8,12-tetramethoxy-1,2-dihydrobenzo[ghi]perylene-4,11-dioneBenzo[ghi]perylene-4, 1,2-diacetyl-1,2-dihydro-5,10-dihydroxy-3,7,8,12-tetra methoxy-, trans-
Show more names
ElsinochromeBenzo[ghi]perylene-4,11-dione, 1,2-diacetyl-1,2-dihydro-5,10-dihydroxy-3,7,8,12-tetramethoxy-, (1R,2R)-rel-
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 1,110
Physicochemical properties
- Boiling point
- 927.9 · 927.9±65.0 °C(Predicted)
- Density
- 1.55 · 1.55±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- solubility
- Ethanol: soluble
- form
- A solid
- pka
- 6.68 · 6.68±0.60(Predicted)
Chemistry & industry
Applications
UsesElsinochrome A is a perylene quinone photosensitizer, and can generate reactive oxygen species (ROS) to induce apoptosis and autophagy under light excitation. Elsinochrome A also shows antifungal activity against C. albicans biofilm through photodynamic antimicrobial chemotherapy (PACT). Elsinochrome A can be used for research of photodynamic therapy (PDT) (Ex: 460 nm)[1][2].
Suppliers14 total
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
ChemeGen 中国18818260767 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
河南天孚化工有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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