HYPOCRELLIN A | CAS No. 77029-83-5

HYPOCRELLIN A

Basic Information

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CAS Number

77029-83-5

Molecular Formula

C30H26O10

Molecular Weight

546.52 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Red powder

Boiling Point

894°C at 760 mmHg

SMILES

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CC(=O)C1C2=C3C4=C(CC1(C)O)C(=C(C5=C4C(=C6C3=C(C(=O)C=C6OC)C(=C2OC)O)C(=CC5=O)OC)O)OC

InChI

InChI=1S/C30H26O10/c1-10(31)25-24-22-16-11(9-30(25,2)36)28(39-5)26(34)17-12(32)7-14(37-3)19(21(16)17)20-15(38-4)8-13(33)18(23(20)22)27(35)29(24)40-6/h7-8,25,34-36H,9H2,1-6H3

InChIKey

VANSZAOQCMTTPB-UHFFFAOYSA-N

LogP

3.320700000000002

Topological Polar Surface Area

148.82 Å²

Hydrogen Bond Donor/Acceptor

3 / 10

Complexity

1180

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

(12R,13S)-12-acetyl-9,13,17-trihydroxy-5,10,16,21-tetramethoxy-13-methylhexacyclo[13.8.0.0^{2,11.0^{3,8.0^{4,22.0^{18,23]tricosa-1(15),2(11),3(8),4(22),5,9,16,18(23),20-nonaene-7,19-dione
hypocrellin a
AS-83271
E0010
FT-0777753
12-acetyl-9,13,17-trihydroxy-5,10,16,21-tetramethoxy-13-methylhexacyclo[13.8.0.02,11.03,8.04,22.018,23]tricosa-1(15),2(11),3(8),4(22),5,9,16,18(23),20-nonaene-7,19-dione
NSC635470
SCHEMBL13478188
CS-0022912
11-Acetyl-3,8,12-trihydroxy-1,5,6,10-tetramethoxy-12-methyl-12,13-dihydro-2H-cyclohepta[ghi]perylene-2,9(11H)-dione
CHEMBL4174675
NSC-635470
AKOS040758769
acetyl-trihydroxy-tetramethoxy-methyl-[?]dione
1-Acetyl-2,6,11-trihydroxy-4,8,9,13-tetramethoxy-2-methyl-2,3-dihydro-1H-cyclohepta[ghi]perylene-5,12-dione
77029-83-5
HY-N2575
SCHEMBL14600287
Isohypocrelline
CHEBI:206195
1H-Cyclohepta[ghi]perylene-5,12-dione,1-acetyl-2,3-dihydro-2,6,11-trihydroxy-4,8,9,13-tetramethoxy-2-methyl-,stereoisomer
1H-Cyclohepta[ghi]perylene-5,12-dione,1-acetyl-2,3-dihydro-2,6,11-trihydroxy-4,8,9,13-tetramet...
HYPOCRELLIN A
HYPOCRELLIN
Rel-Hypocrellin A
API0016540
Hypocrellin A

MDL Number

MFCD00467740

FAQ

What is Hypocrellin A (CAS: 77029-83-5)?

Hypocrellin A is a naturally occurring photosensitizer with a chemical formula of C42H36O6. It is known for its unique photodynamic properties and is used in various applications including photodynamic therapy and as a research tool.

What are the main uses of Hypocrellin A (CAS: 77029-83-5)?

Hypocrellin A is primarily used in photodynamic therapy for cancer treatment. It is also utilized in biomedical research for studying photodynamic processes and as an ingredient in some pharmaceutical products.

Is Hypocrellin A (CAS: 77029-83-5) safe?

Hypocrellin A is generally considered safe for use in photodynamic therapy, but it should be handled with care. Users should be aware of potential skin sensitization and follow protective measures such as avoiding prolonged sun exposure and wearing protective clothing.

How should Hypocrellin A (CAS: 77029-83-5) be stored?

Hypocrellin A should be stored in a cool, dark place to prevent degradation. It should be kept in a tightly sealed container to protect it from moisture. Avoid storing it above room temperature and ensure it is away from direct sunlight.