camptothecin

Chemical Formula:

C₂₀H₁₆N₂O₄

Molecular Weight:

348.357 Daltons

Monoisotopic Mass:

348.1110070124 Daltons

SMILES:

CCC1(O)(C(=O)OCC2(=C1C=C3(N(C(=O)2)CC4(C3=NC5(=C(C=4)C=CC=C5)))))

InChI:

1S/C20H16N2O4/c1-2-20(25)14-8-16-17-12(7-11-5-3-4-6-15(11)21-17)9-22(16)18(23)13(14)10-26-19(20)24/h3-8,25H,2,9-10H2,1H3/t20-/m0/s1

InChIKey:

VSJKWCGYPAHWDS-FQEVSTJZSA-N

Synonyms

Databases

MetaCyc: CPD-11776

RefMet: Camptothecin

MetaboLights: MTBLC27656

DRUGBANK: DB04690

ChemSpider: 22775

KEGG: C01897

ChEBI: 27656

PubChem (CID): 24360

Seed: cpd01304

MetaNetX: MNXM8363