Summary

Molecular formula: C30H26O10
SMILES: COc1c(O)c2C(=O)C=C(c3c2c2c1CC(C)(O)C(c1c2c2c3C(=CC(=O)c2c(c1OC)O)OC)C(=O)C)OC
InChI: InChI=1S/C30H26O10/c1-10(31)25-24-22-16-11(9-30(25,2)36)28(39-5)26(34)17-12(32)7-14(37-3)19(21(16)17)20-15(38-4)8-13(33)18(23(20)22)27(35)29(24)40-6/h7-8,25,34-36H,9H2,1-6H3
InChIKey: VANSZAOQCMTTPB-UHFFFAOYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=c1ccc2c3ccc(=O)c4ccc5c(c6c(ccc1c26)CCC5)c43

Scaffold Graph/Node level:
OC1CCC2C3CCC(O)C4CCC5CCCC6CCC1C2C6C5C43

Scaffold Graph level:
CC1CCC2C3CCC(C)C4CCC5CCCC6CCC1C2C6C5C43

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Chemical classification

Kingdom: Organic compounds
Super class: Benzenoids
Class: Perylenequinones

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Synonymous chemical names:
hypocrellin a

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External chemical identifiers:
CID_3664; CAS_77029-83-5; NPATLAS_NPA014636; CHEMSPIDER_19979664; Molport_MolPort-047-499-973

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Chemical structure download