Summary

Molecular formula: C27H29NO8
SMILES: C/C(=CCc1c(O)cc2c(c1O)CN(C2=O)[C@H](C(=O)O)Cc1ccc(cc1)O)/CC/C=C(/C(=O)O)C
InChI: InChI=1S/C27H29NO8/c1-15(4-3-5-16(2)26(33)34)6-11-19-23(30)13-20-21(24(19)31)14-28(25(20)32)22(27(35)36)12-17-7-9-18(29)10-8-17/h5-10,13,22,29-31H,3-4,11-12,14H2,1-2H3,(H,33,34)(H,35,36)/b15-6+,16-5+/t22-/m0/s1
InChIKey: DKVHZNJBJLBPIL-ZENJFMIYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1c2ccccc2CN1CCc1ccccc1

Scaffold Graph/Node level:
OC1C2CCCCC2CN1CCC1CCCCC1

Scaffold Graph level:
CC1C(CCC2CCCCC2)CC2CCCCC21

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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:
caputmedusin d

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Chemical structure download