Spectrum NGA02748 for 10-hydroxycamptothecin

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
Alkaloids
InChI=1S/C20H16N2O5/c1-2-20(26)14-7-16-17-11(5-10-6-12(23)3-4-15(10)21-17)8-22(16)18(24)13(14)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3
HAWSQZCWOQZXHI-UHFFFAOYSA-N
C20H16N2O5
364.105921612
O=C1OCC=2C(=O)N3C(=CC2C1(O)CC)C=4N=C5C=CC(O)=CC5=CC4C3

Mass Spectral Metadata

NameValue
NGA02748
2018.04.04
Nogawa T, Okano A, CSRS, RIKEN
BY-CC
SubCategory_DNP: : Alkaloids derived from anthranilic acid, Quinoline alkaloids
364.3609
Agilent 6410 Triple Quadrupole LC/MS system
LC-ESI-QQQ
MS2
positive
3.644704330129621
0.8522302720625216
[M+H]+
365.113891612
0.0 ppm
0.0 Da