Summary

Molecular formula: C16H18O7
SMILES: C=C1[C@H](O)CC[C@]([C@@H]1O)(CC(=O)c1cc(O)ccc1O)C(=O)O
InChI: InChI=1S/C16H18O7/c1-8-11(18)4-5-16(14(8)21,15(22)23)7-13(20)10-6-9(17)2-3-12(10)19/h2-3,6,11,14,17-19,21H,1,4-5,7H2,(H,22,23)/t11-,14-,16-/m1/s1
InChIKey: GZVVHHXNPRBBSD-DJSGYFEHSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C=C1CCCC(CC(=O)c2ccccc2)C1

Scaffold Graph/Node level:
CC1CCCC(CC(O)C2CCCCC2)C1

Scaffold Graph level:
CC1CCCC(CC(C)C2CCCCC2)C1

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Chemical classification

Kingdom: Organic compounds
Super class: Organic oxygen compounds
Class: Organooxygen compounds
Sub class: Carbonyl compounds

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Synonymous chemical names:
(+)-applanatumol k

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External chemical identifiers:
CID_139588386; NPATLAS_NPA018956; CHEMSPIDER_78441508

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Chemical structure download