Summary

Molecular formula: C26H40O7
SMILES: CO[C@H]1C[C@@H]2C3=C(CC[C@]3(C)CC[C@]2([C@H](C=C1C=O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)C)C(C)C
InChI: InChI=1S/C26H40O7/c1-14(2)16-6-7-25(3)8-9-26(4)17(21(16)25)11-19(31-5)15(12-27)10-20(26)33-24-23(30)22(29)18(28)13-32-24/h10,12,14,17-20,22-24,28-30H,6-9,11,13H2,1-5H3/t17-,18-,19+,20+,22+,23-,24+,25-,26-/m1/s1
InChIKey: WUQTXLXCAOVKPK-MXYVVECVSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CC(OC2CCCCO2)C2CCC3CCC=C3C2CC1

Scaffold Graph/Node level:
C1CCC(OC2CCCCC3C4CCCC4CCC23)OC1

Scaffold Graph level:
C1CCC(CC2CCCCC3C4CCCC4CCC23)CC1

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Prenol lipids
Sub class: Diterpenoids

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Synonymous chemical names:
erinacine v

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External chemical identifiers:
CID_139589561; NPATLAS_NPA021789; CHEMSPIDER_78438855

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Chemical structure download