Summary

Molecular formula: C28H38O6
SMILES: O=C1CC[C@]2(C(=C1)[C@H](O)[C@H](C1=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)O)C
InChI: InChI=1S/C28H38O6/c1-14-17-9-12-27(34-28(14)23(32)15(2)24(3,4)33-28)20-18(8-11-26(17,27)6)25(5)10-7-16(29)13-19(25)21(30)22(20)31/h8,11,13-15,17,21-23,30-32H,7,9-10,12H2,1-6H3/t14-,15-,17+,21-,22-,23+,25+,26+,27-,28-/m0/s1
InChIKey: GKTIPUYIQKAQLI-LTGVEDDOSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=C2CCC3=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 v1

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External chemical identifiers:
CID_101213283; NPATLAS_NPA014776; CHEMSPIDER_78438041; ZINC_ZINC000255212418

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Chemical structure download