Summary

Molecular formula: C21H24O6
SMILES: Oc1ccc(c(c1)C1=C/C(=C/C=C/[C@]2(C)CC[C@H](O2)C(O)(C)C)/C(=O)O1)O
InChI: InChI=1S/C21H24O6/c1-20(2,25)18-8-10-21(3,27-18)9-4-5-13-11-17(26-19(13)24)15-12-14(22)6-7-16(15)23/h4-7,9,11-12,18,22-23,25H,8,10H2,1-3H3/b9-4+,13-5-/t18-,21+/m0/s1
InChIKey: ZCBZIKUEIKEDHK-DVVMZBMZSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1OC(c2ccccc2)=CC1=CC=CC1CCCO1

Scaffold Graph/Node level:
OC1OC(C2CCCCC2)CC1CCCC1CCCO1

Scaffold Graph level:
CC1CC(C2CCCCC2)CC1CCCC1CCCC1

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Chemical classification

Kingdom: Organic compounds
Super class: Benzenoids
Class: Phenols
Sub class: Benzenediols

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Synonymous chemical names:
(-)-ganotheaecolumol e

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External chemical identifiers:
CID_139590281; NPATLAS_NPA022986; CHEMSPIDER_78441725

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Chemical structure download