Description
3β-Isodihydrocadambine 4-oxide is a potent antitumor compound manifesting remarkable efficacy by selectively targeting and suppressing the growth of malignant cells. Its impressive outcomes in preclinical investigations not only substantiate its prowess but also highlight its infiltration into pivotal cellular cascades, consequently triggering apoptosis.
Synonyms
3Beta-Isodihydrocadambine 4-oxide
IUPAC Name
methyl (1S,14R,15S,16S,20S)-14-(hydroxymethyl)-13-oxido-16-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-oxa-3-aza-13-azoniapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4,6,8,18-pentaene-19-carboxylate
Molecular Formula
C27H34N2O11
Canonical SMILES
COC(=O)C1=COC(C2C1CC3C4=C(CC[N+]3(C2CO)[O-])C5=CC=CC=C5N4)OC6C(C(C(C(O6)CO)O)O)O
InChI
InChI=1S/C27H34N2O11/c1-37-25(35)15-11-38-26(40-27-24(34)23(33)22(32)19(10-31)39-27)20-14(15)8-17-21-13(6-7-29(17,36)18(20)9-30)12-4-2-3-5-16(12)28-21/h2-5,11,14,17-20,22-24,26-28,30-34H,6-10H2,1H3/t14-,17+,18+,19-,20+,22-,23+,24-,26+,27+,29?/m1/s1
InChIKey
NVUHVENKCFNJQW-GDPYHQKMSA-N