Summary

Molecular formula: C28H36O4
SMILES: O=C1CC[C@]2(C(=C1)C=CC1=C2C=C[C@]2([C@@]31CC[C@@H]2[C@@H]([C@@]1(O3)OC([C@H]([C@H]1O)C)(C)C)C)C)C
InChI: InChI=1S/C28H36O4/c1-16-20-11-14-27(32-28(16)23(30)17(2)24(3,4)31-28)22-8-7-18-15-19(29)9-12-25(18,5)21(22)10-13-26(20,27)6/h7-8,10,13,15-17,20,23,30H,9,11-12,14H2,1-6H3/t16-,17-,20+,23+,25-,26+,27-,28-/m0/s1
InChIKey: YOKQBCLMOKKBED-AJZAVILDSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=C2C=CC3=C(C=CC4C5CCC34OC3(CCCO3)C5)C2CC1

Scaffold Graph/Node level:
OC1CCC2C(CCC3C2CCC2C4CCC23OC2(CCCO2)C4)C1

Scaffold Graph level:
CC1CCC2C(CCC3C2CCC2C4CCC23CC2(CCCC2)C4)C1

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Chemical classification

Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Naphthopyrans

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Synonymous chemical names:
blazeispirol u

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External chemical identifiers:
CID_101213282; NPATLAS_NPA005983; CHEMSPIDER_78436957; ZINC_ZINC000255284852

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Chemical structure download