Summary

Molecular formula: C26H26N2O5
SMILES: O=C1O[C@H]2CC(C)(C)[C@H]3[C@@]4(C2=N[C@H]1Cc1c[nH]c2c1cccc2)C(=O)OC1[C@H]4C(=CC3)CO1
InChI: InChI=1S/C26H26N2O5/c1-25(2)10-18-21(26-19(25)8-7-13-12-31-23(20(13)26)33-24(26)30)28-17(22(29)32-18)9-14-11-27-16-6-4-3-5-15(14)16/h3-7,11,17-20,23,27H,8-10,12H2,1-2H3/t17-,18-,19-,20+,23?,26+/m0/s1
InChIKey: KJGOXXYRSAWVEF-LNXYMLJESA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1OC2CCC3CC=C4COC5OC(=O)C3(C2=NC1Cc1c[nH]c2ccccc12)C45

Scaffold Graph/Node level:
OC1OC2CCC3CCC4COC5OC(O)C3(C2NC1CC1CNC2CCCCC12)C45

Scaffold Graph level:
CC1CC2CCC3CCC4CCC5CC(C)C3(C2CC1CC1CCC2CCCCC21)C45

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Chemical classification

Kingdom: Organic compounds
Super class: Organic acids and derivatives
Class: Carboxylic acids and derivatives
Sub class: Amino acids, peptides, and analogues

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Synonymous chemical names:
schizine b

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External chemical identifiers:
CID_122179283; NPATLAS_NPA014335; CHEMSPIDER_58859713

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Chemical structure download