Basic information
- CAS
86639-63-6- Standard SMILES
CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3cc(N)ccc3nc2-1- InChIKey
MVUUMBZAHAKPKQ-FQEVSTJZSA-N- Molecular formula
- C20H17N3O4
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.12190603
Names & identifiers
- Preferred name
- 10-Aminocamptothecin
- IUPAC
- (19S)-7-amino-19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaene-14,18-dione
- English name
- 9-amino-20-camptothecin
- Molecular formula
- C20H17N3O4
- Molecular weight
- 363.37
Names & synonyms
10-Aminocamptothecin86639-63-610-amino-20(S)-camptothecinDTXSID30131522310-Amino-cptRefChem:7743710-aminocamptothecin, (S)-DTXCID301745127Camptothecin, 10-amino-CHEMBL102252(19S)-7-amino-19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaene-14,18-dione(4S)-9-Amino-4-ethyl-4-hydroxy-1H-pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4H,12H)-dione
Show more names
9-amino-20-camptothecin1H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 9-amino-4-ethyl-4-hydroxy-, (4S)-
(4s)-9-amino-4-ethyl-4-hydroxy-1h-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4h,12h)-dione1H-Pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4H,12H)-dione, 9-amino-4-ethyl-4-hydroxy-, (S)-orb3181862SCHEMBL1727366ANTINEOPLASTIC-652524MVUUMBZAHAKPKQ-FQEVSTJZSA-NBDBM50406990NSC652524
Database identifiers
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 775
Physicochemical properties
- Boiling point
- 825.9 · 825.9±65.0 °C(Predicted)
- Density
- 1.55 · 1.55±0.1 g/cm3(Predicted)
- pka
- 11.23 · 11.23±0.20(Predicted)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 501 · P501-P270-P264-P301+P310+P330-P405
Safety & regulation
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301
- Precautionary statements
- P501-P270-P264-P301+P310+P330-P405
Chemistry & industry
Applications
Uses10-Aminocamptothecin is a derivative of Camptothecin (C175150), an antitumor compound used in the treatment of hyperproliferative diseases.
Suppliers6 total
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
上海润栖医药科技有限公司021-38751876 15000076078 · [email protected]
重庆卡兰医药有限公司[email protected]
上海语锌医药科技有限公司15921286451; 15921286451 · [email protected]
Related reactions
4 records
Compound notes
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