Summary

Molecular formula: C28H40O5
SMILES: CC(=O)CC[C@@]1(C)C(=O)C=CC2=C1CC[C@]1([C@@]32CC[C@@H]1[C@@H]([C@@]1(O3)OC([C@H]([C@H]1O)C)(C)C)C)C
InChI: InChI=1S/C28H40O5/c1-16(29)10-13-25(6)20-11-14-26(7)19-12-15-27(26,21(20)8-9-22(25)30)33-28(17(19)2)23(31)18(3)24(4,5)32-28/h8-9,17-19,23,31H,10-15H2,1-7H3/t17-,18-,19+,23+,25+,26+,27-,28-/m0/s1
InChIKey: JASZNDQUKJVDQJ-NAKLDNGTSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=CC2=C(CCC3C4CCC23OC2(CCCO2)C4)C1

Scaffold Graph/Node level:
OC1CCC2C(CCC3C4CCC23OC2(CCCO2)C4)C1

Scaffold Graph level:
CC1CCC2C(CCC3C4CCC23CC2(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 z1

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External chemical identifiers:
CID_101213281; NPATLAS_NPA018720; CHEMSPIDER_78438516; ZINC_ZINC000238778006

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Chemical structure download