Summary

Molecular formula: C20H14O4
SMILES: COC1=C(c2ccccc2)C(=O)C2=C(C1=O)c1ccccc1CO2
InChI: InChI=1S/C20H14O4/c1-23-19-15(12-7-3-2-4-8-12)17(21)20-16(18(19)22)14-10-6-5-9-13(14)11-24-20/h2-10H,11H2,1H3
InChIKey: IIJJGBPPKPHWQB-UHFFFAOYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=C(c2ccccc2)C(=O)C2=C1c1ccccc1CO2

Scaffold Graph/Node level:
OC1CC(C2CCCCC2)C(O)C2OCC3CCCCC3C12

Scaffold Graph level:
CC1CC(C2CCCCC2)C(C)C2CCC3CCCCC3C12

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Chemical classification

Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Benzopyrans
Sub class: 2-benzopyrans

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Synonymous chemical names:
betulinan b

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External chemical identifiers:
CID_3050396; CAS_184092-49-7; NPATLAS_NPA011707; CHEMSPIDER_2312462

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Chemical structure download