Summary

Molecular formula: C16H18O6
SMILES: OCC([C@H]1CC[C@H]2[C@@](C1=O)(O)Oc1c(C2=O)cc(cc1)O)C
InChI: InChI=1S/C16H18O6/c1-8(7-17)10-3-4-12-14(19)11-6-9(18)2-5-13(11)22-16(12,21)15(10)20/h2,5-6,8,10,12,17-18,21H,3-4,7H2,1H3/t8?,10-,12-,16-/m1/s1
InChIKey: YNHPWMXJGUOPOK-NOXQYYELSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1c2ccccc2OC2C(=O)CCCC12

Scaffold Graph/Node level:
OC1CCCC2C(O)C3CCCCC3OC12

Scaffold Graph level:
CC1CCCC2C(C)C3CCCCC3CC12

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Chemical classification

Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Benzopyrans
Sub class: 1-benzopyrans

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Synonymous chemical names:
applanatin b

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External chemical identifiers:
CID_101447371; NPATLAS_NPA011931; CHEMSPIDER_78441196

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Chemical structure download