Molecule record

[(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate

C₃₃H₃₈N₄O₆

586.69 g/mol

Loading structure

Molecular properties

Formula: C₃₃H₃₈N₄O₆
Molar mass: 586.69 g·mol⁻¹
Exact mass: 586.2791 Da
: 17
PubChem CID: 60838

Functional groups

Alcohol

Alkane / alkyl carbon

Amide

Aromatic ring

Ester

Ether

Tertiary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

(+)-7-ethyl-10-hydroxycamptothecine 10-(1,4'-bipiperidine)-1'-carboxylate
(+)-Irinotecan
691-567-9
7-ethyl-10-(4-(1-piperidino)-1-piperidino)carbonyloxycamptothecin
97682-44-5
Biotecan
CHEBI:80630
DTXCID9021051

Show all 24 synonyms

DTXSID1041051
HSDB 7607
Irinophore C
Irinotecan lactone
Irinotecan mylan
Irinotecanum
Irrinotecan
L01XX19
NSC-728073
NSC616348
NSC728073
RefChem:56366
SN-38-11
SN3811
camptothecin-11
irinotecan

Structure identifiers

Canonical SMILES: CCc1c2c(nc3ccc(OC(=O)N4CCC(N5CCCCC5)CC4)cc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC
Isomeric SMILES: CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)[C@@]4(CC)O)C2=NC5=C1C=C(C=C5)OC(=O)N6CCC(CC6)N7CCCCC7
InChI: InChI=1S/C33H38N4O6/c1-3-22-23-16-21(43-32(40)36-14-10-20(11-15-36)35-12-6-5-7-13-35)8-9-27(23)34-29-24(22)18-37-28(29)17-26-25(30(37)38)19-42-31(39)33(26,41)4-2/h8-9,16-17,20,41H,3-7,10-15,18-19H2,1-2H3/t33-/m0/s1
InChIKey: UWKQSNNFCGGAFS-XIFFEERXSA-N
PubChem CID: 60838

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library

No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for [(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for [(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)

Open source record