Summary

Molecular formula: C20H28O5
SMILES: OCC1=CC=C2[C@@]([C@H]([C@@H]1O)O)(C)CC[C@@]1(C2=C(C(C)C)C(=O)[C@@H]1O)C
InChI: InChI=1S/C20H28O5/c1-10(2)13-14-12-6-5-11(9-21)15(22)17(24)19(12,3)7-8-20(14,4)18(25)16(13)23/h5-6,10,15,17-18,21-22,24-25H,7-9H2,1-4H3/t15-,17+,18+,19-,20-/m1/s1
InChIKey: BACAPWYIFVJCTR-DABHTEOTSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=C2C3=CC=CCCC3CCC2C1

Scaffold Graph/Node level:
OC1CC2CCC3CCCCCC3C2C1

Scaffold Graph level:
CC1CC2CCC3CCCCCC3C2C1

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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:
cyathin n

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External chemical identifiers:
ZINC_ZINC000238757168

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Chemical structure download