9-Aminocamptothecin

C20H17N3O4CAS 91421-43-1363.37 g/mol

OHOONONH2N
AlcoholEsterLactonePrimary amine

Properties

Molecular formula
C20H17N3O4
Molar mass
363.37 g/mol
Exact mass
363.1219 Da
Melting point
142–145 °C
logP
1.66Crippen estimate
Polar surface area
107.4 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
1
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
91421-43-1
SMILES
CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(N)cccc3nc2-1
InChIKey
FUXVKZWTXQUGMW-FQEVSTJZSA-N
InChI
InChI=1S/C20H17N3O4/c1-2-20(26)13-7-16-17-10(6-11-14(21)4-3-5-15(11)22-17)8-23(16)18(24)12(13)9-27-19(20)25/h3-7,26H,2,8-9,21H2,1H3/t20-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 1H-Pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 10-amino-4-ethyl-4-hydroxy-, (4S)-
  • 1H-Pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 10-amino-4-ethyl-4-hydroxy-, (S)-
  • (4S)-10-Amino-4-ethyl-4-hydroxy-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
  • NSC 603071
  • 9-Amino-20(S)-camptothecin
  • (S)-10-Amino-4-ethyl-4-hydroxy-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione

Work with 9-Aminocamptothecin

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere