(14S,27R)-22,33-Dimethoxy-13,28-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.2~16,19~.1~3,10~.1~21,25~.0~4,8~.0~14,39~.0~31,35~]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dod ecaene

Basic Information

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CAS Number

481-49-2

Molecular Formula

C37H38N2O6

Molecular Weight

606.72 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Powder

Melting Point

145-155°

Boiling Point

654.03°C (rough estimate)

Solubility

Acetontrile,DMSO

Refractive Index

1.5300 (estimate)

Specific Rotation

D20 +277° (c = 2 in chloroform)

SMILES

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CN1CCc2cc(c3cc2[C@H]1Cc4ccc(c(c4)Oc5ccc(cc5)C[C@H]6c7c(cc8c(c7O3)OCO8)CCN6C)OC)OC

InChI

InChI=1S/C37H38N2O6/c1-38-13-11-24-18-31(41-4)33-20-27(24)28(38)16-23-7-10-30(40-3)32(17-23)44-26-8-5-22(6-9-26)15-29-35-25(12-14-39(29)2)19-34-36(37(35)45-33)43-21-42-34/h5-10,17-20,28-29H,11-16,21H2,1-4H3/t28-,29+/m1/s1

InChIKey

YVPXVXANRNDGTA-WDYNHAJCSA-N

LogP

6.87390000000001

Topological Polar Surface Area

61.860000000000014 Å²

Hydrogen Bond Donor/Acceptor

0 / 8

Complexity

994

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

Cepharanthine
6',12'-DIMETHOXY-2,2'-DIMETHYL-6,7-(METHYLENEBIS(OXY)OXYACANTHAN)
CEPHARANTHIN
OXYACANTHAN,6',12'-DIMETHOXY-2,2'-DIMETHYL-6,7-(METHYLLENEBIS (OXY))-
cepharantin
o-methylcepharanoline
Stephanotis
CEPHARANTHINE(RG)
[methylenebis(oxy)]
6',12'-dimethoxy-2,2'-dimethyl-6,7-[methylenebis-(oxy)]oxyacanthan
6,7-methanediyldioxy-6',12'-dimethoxy-2,2'-dimethyl-oxyacanthane
CEPHARANTHINUM
ChroMiuM(0) hexacarbonyl
sepharanthine
(+)-Cepharanthine
6′,12′-Dimethoxy-2,2′-dimethyl-6,7-(methylenebis(oxy))oxyacanthan
CEP
NSC 623442
[14aS-(14aR*,26aS*)]-2,3,13,14,14a,15,26,26a-octahydro-22,30-dimethoxy-1,14-dimethyl- H-4,6:16,19-Dietheno-21,25-metheno-12H-[1,3]dioxolo[4,5-g]pyrido[2′,3′:17,18][1,10]dioxacycloeicosino[2,3,4-ij]isoquinoline
6',12'-Dimethoxy-2,2'-dimethyl-6,7-(methylenebis(oxy))-oxyacanthan
[ "" ]
Cepharanthine [JAN]
C37H38N2O6
6',12'-Dimethoxy-2,2'-dimethyl-6,7-(methylenebis(oxy))oxyacanthan
7592YJ0J6T
NSC623442
Cepharanthine (JAN)
ecaene (non-preferred name)
DSSTox_RID_81253
DSSTox_CID_25957
DSSTox_GSID_45957

MDL Number

MFCD00210482

FAQ

What is (14S,27R)-22,33-Dimethoxy-13,28-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.2~16,19~.1~3,10~.1~21,25~.0~4,8~.0~14,39~.0~31,35~]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dodecaene (CAS: 481-49-2)?

The compound (14S,27R)-22,33-Dimethoxy-13,28-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.2~16,19~.1~3,10~.1~21,25~.0~4,8~.0~14,39~.0~31,35~]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dodecaene (CAS: 481-49-2) is a complex polyether with multiple oxygen and nitrogen atoms in its structure. It exhibits high molecular weight and is primarily known for its biological activity, particularly in natural product chemistry and medicinal research. The compound has a unique stereochemistry with designated chiral centers at positions 14 and 27.

What are the main uses of (14S,27R)-22,33-Dimethoxy-13,28-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.2~16,19~.1~3,10~.1~21,25~.0~4,8~.0~14,39~.0~31,35~]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dodecaene (CAS: 481-49-2)?

This compound is primarily used in pharmaceutical research, particularly for its potential as a bioactive agent. It is also of interest in synthetic chemistry due to its complex ring system and functional groups, which can be modified for various applications. In the field of natural products, it may be studied for its biological properties, including antimicrobial or antifungal activities. Additionally, it is used in chemical synthesis as a structural template for developing new compounds with specific functionalities.

Is (14S,27R)-22,33-Dimethoxy-13,28-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.2~16,19~.1~3,10~.1~21,25~.0~4,8~.0~14,39~.0~31,35~]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dodecaene (CAS: 481-49-2) safe?

The safety of (14S,27R)-22,33-Dimethoxy-13,28-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.2~16,19~.1~3,10~.1~21,25~.0~4,8~.0~14,39~.0~31,35~]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dodecaene (CAS: 481-49-2) depends on its application. As a research compound, it is generally considered safe when handled under proper laboratory conditions. However, precautions should be taken to avoid direct skin contact and inhalation. It is advisable to follow standard safety protocols, including the use of protective gloves and eyewear, and to work in a well-ventilated area.

How should (14S,27R)-22,33-Dimethoxy-13,28-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.2~16,19~.1~3,10~.1~21,25~.0~4,8~.0~14,39~.0~31,35~]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dodecaene (CAS: 481-49-2) be stored?

The compound should be stored in a cool, dry, and dark place to maintain its stability. It is recommended to keep it in a sealed container away from moisture and air to prevent degradation. Storage at a temperature below 25°C is ideal, and it should be protected from light exposure. For safety, it is best stored in a well-ventilated chemical storage cabinet, and users should avoid direct contact with the compound during handling.