CC-1065
Grundinformationen
- CAS
69866-21-3- Standard-SMILES
COc1c(O)c2c(c3cc(C(=O)N4CCc5c4c(O)c(OC)c4[nH]c(C(=O)N6CC7CC78C6=CC(=O)c6[nH]cc(C)c68)cc54)[nH]c13)CCN2C(N)=O- InChIKey
UOWVMDUEMSNCAV-UHFFFAOYSA-N- Summenformel
- C37H33N7O8
- Durchschnittliche Molmasse
- 703,7 g/mol
- Monoisotopische Masse
- 703,23906104
Namen und Bezeichner
- Bevorzugter Name
- CC-1065
- IUPAC
- 5-hydroxy-2-[5-hydroxy-4-methoxy-2-(3-methyl-7-oxo-5,10-diazatetracyclo[7.4.0.01,12.02,6]trideca-2(6),3,8-triene-10-carbonyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-6-carbonyl]-4-methoxy-7,8-dihydro-3H-pyrrolo[3,2-e]indole-6-carboxamide
- Englischer Name
- Rachelmycin
- Summenformel
- C37H33N7O8
- Molmasse
- 703.7
Namen und Synonyme
CC-10655-hydroxy-2-[5-hydroxy-4-methoxy-2-(3-methyl-7-oxo-5,10-diazatetracyclo[7.4.0.01,12.02,6]trideca-2(6),3,8-triene-10-carbonyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-6-carbonyl]-4-methoxy-7,8-dihydro-3H-pyrrolo[3,2-e]indole-6-carboxamideCC 10655-hydroxy-2-(5-hydroxy-4-methoxy-2-(3-methyl-7-oxo-5,10-diazatetracyclo(7.4.0.01,12.02,6)trideca-2(6),3,8-triene-10-carbonyl)-7,8-dihydro-3H-pyrrolo(3,2-e)indole-6-carbonyl)-4-methoxy-7,8-dihydro-3H-pyrrolo(3,2-e)indole-6-carboxamideRefChem:918155NSC298223NSC-298223CHEMBL152578SCHEMBL14586762SCHEMBL29352114CHEBI:223705UOWVMDUEMSNCAV-UHFFFAOYSA-N
Weitere Namen anzeigen
RachelmycinUOWVMDUEMSNCAV-WYENRQIDSA-NBenzo[1,2-b:4,3-b']dipyrrole-3(2H)-carboxamide, 7-[[1,6-dihydro-4-hydroxy-5-methoxy-7-[[(7bR,8aS)-4,5,8,8a-tetrahydro-7-methyl-4-oxocyclopropa[c]pyrrolo[3,2-e]indol-2(1H)-yl]carbonyl]benzo[1,2-b:4,3-b']dipyrrol-3(2H)-yl]carbonyl]-1,6-dihydro-4-hydroxy-5-methoxy-
NSC617542NSC-617542NCI60_002495U-56314Benzo[1,3-b']dipyrrole-3(2H)-carboxamide, 7-[[1,6-dihydro-4-hydroxy-5-methoxy-7-[(4,5,8,8a-tetrahydro-7-methyl-4-oxocyclopropa[c]pyrrolo[3,2-e]indol-2(1H)-yl)carbonyl]benzo[1,2-b:4,3-b']dipyrrol-3(2H)-yl]carbonyl]-1,6-dihydro-4-hydroxy-5-methoxy-
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,4
- Polarare Oberfläche (TPSA)
- 210 Ų
- H-Brücken-Donoren
- 6
- H-Brücken-Akzeptoren
- 8
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 52
- Formalladung
- 0
- Komplexität
- 1.610
Physikochemische Eigenschaften
- Siedepunkt
- 704.36 °C · 704.36°C (rough estimate)
- Dichte
- 1.2929 · 1.2929 (rough estimate)
- Brechungsindex
- 1.691 · 1.6910 (estimate)
- Farbe
- Clustered needles or amorphous amber-coloredfoam
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological Classification
Chemical substances, produced by microorganisms, inhibiting or preventing the proliferation of neoplasms.
A class of drugs that differs from other alkylating agents used clinically in that they are monofunctional and thus unable to cross-link cellular macromolecules. Among their common properties are a requirement for metabolic activation to intermediates with antitumor efficacy and the presence in their chemical structures of N-methyl groups, that after metabolism, can covalently modify cellular DNA. The precise mechanisms by which each of these drugs acts to kill tumor cells are not completely understood. (From AMA, Drug Evaluations Annual, 1994, p2026)
Anbieter2 Anbieter
MedChemExpress[email protected]
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
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