Protohypericin

Basic Information

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CAS Number

548-03-8

Molecular Formula

C30H18O8

Molecular Weight

506.5 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

Solubility

Insuluble (2.2E-9 g/L) (25 ºC),

SMILES

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CC1=CC(=O)C2=C(C3=C(C=C(C4=C3C(=C5C6=CC(=CC(=O)C6=C(C7=C(C=C(C4=C57)O)O)O)C)C2=C1)O)O)O

InChI

InChI=1S/C30H18O8/c1-9-3-11-19(13(31)5-9)29(37)25-17(35)7-15(33)23-24-16(34)8-18(36)26-28(24)22(21(11)27(23)25)12-4-10(2)6-14(32)20(12)30(26)38/h3-8,33-38H,1-2H3

InChIKey

DPKVSJZTYNGFAW-UHFFFAOYSA-N

LogP

5.052240000000006

Topological Polar Surface Area

155.52 Å²

Hydrogen Bond Donor/Acceptor

6 / 8

Complexity

1270

Synonyms & References

English

NS00094673
Dibenzo(a,o)perylene-7,16-dione, 1,3,4,6,8,15-hexahydroxy-10,11-dimethyl-
1,3,4,6,8,15-hexahydroxy-10,13-dimethyldibenzo[a,o]perylene-7,16-dione
7,11,13,16,18,22-hexahydroxy-5,24-dimethylheptacyclo[13.11.1.1^{2,10}.0^{3,8}.0^{19,27}.0^{21,26}.0^{14,28}]octacosa-1,3,5,7,10,12,14(28),15,17,19(27),21,23,25-tridecaene-9,20-dione
1,3,4,6,8,15-Hexahydroxy-10,13-dimethyl-dibenzo[a,o]perylene-7,16-dione
HY-N4139
YLILOANQCQKPOD-UHFFFAOYSA-N
Protohypericin
CHEMBL1078768
MS-29408
BCP29229
DTXSID30203269
CS-0032211
AKOS030631733
SCHEMBL19322741
548-03-8
9,11,13,16,18,20-hexahydroxy-5,24-dimethylheptacyclo[13.11.1.12,10.03,8.019,27.021,26.014,28]octacosa-1,3,5,8,10,12,14(28),15(27),16,18,20,23,25-tridecaene-7,22-dione
CHEBI:204898
Dibenzo[a,o]perylene-7,16-dione,1,3,4,6,8,15-hexahydroxy-10,13-dimethyl-
PROTOHYPERICIN(RG)
1,3,4,6,8,15-Hexahydroxy-10,13-dimethyl-dibenzo[a,o]perylen-7,16-dion
1,3,4,6,8,15-hexahydroxy-10,13-dimethyl-dibenzo[a,o]perylene-7,16-dione
Dibenzo(a,o)perylene-7,16-dione,1,3,4,6,8,15-hexahydroxy-10,11-dimethyl
1,3,4,6,8,15-Hexahydroxy-10,13-dimethyldibenzo[a,o]perylene-7,16-dione

MDL Number

MFCD31735132

Customs Code

2914400090

FAQ

What is Protohypericin (CAS: 548-03-8)?

Protohypericin (CAS: 548-03-8) is a natural organic compound with a unique chemical structure, characterized by its ability to absorb light in the visible region. It is known for its photodynamic properties and has been studied for its potential applications in medicine and research.

What are the main uses of Protohypericin (CAS: 548-03-8)?

Protohypericin (CAS: 548-03-8) is primarily used in photodynamic therapy for treating certain types of cancer. It is also utilized in research for studying light-induced reactions and in some industrial applications for its unique photochemical properties.

Is Protohypericin (CAS: 548-03-8) safe?

Protohypericin (CAS: 548-03-8) is generally considered safe when used as directed. However, it can cause photosensitivity, leading to skin reactions upon exposure to sunlight. Appropriate protective measures, such as wearing protective clothing and avoiding prolonged sun exposure, are recommended.

How should Protohypericin (CAS: 548-03-8) be stored?

Protohypericin (CAS: 548-03-8) should be stored in a cool, dry place, away from direct sunlight and heat sources. It is best kept in a tightly sealed container to protect it from moisture and light, which can degrade its stability and effectiveness.