Summary

Molecular formula: C25H36O8
SMILES: CC(C(=O)CC[C@]1(C)CC[C@@]2([C@@H](C1=O)CC=C1[C@@H]3[C@@H]2OC2C3(O)C(C(C1O)(CO2)O)O)C)C
InChI: InChI=1S/C25H36O8/c1-12(2)15(26)7-8-22(3)9-10-23(4)14(18(22)28)6-5-13-16-19(23)33-21-25(16,31)20(29)24(30,11-32-21)17(13)27/h5,12,14,16-17,19-21,27,29-31H,6-11H2,1-4H3/t14-,16-,17?,19+,20?,21?,22-,23-,24?,25?/m1/s1
InChIKey: HVLLJUVTXKLMKW-PWEREOCZSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CCCC2C1CC=C1CC3COC4OC2C1C4C3

Scaffold Graph/Node level:
OC1CCCC2C1CCC1CC3COC4OC2C1C4C3

Scaffold Graph level:
CC1CCCC2C1CCC1CC3CCC4CC2C1C4C3

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Chemical classification

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

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Synonymous chemical names:
erinacine g

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External chemical identifiers:
CID_10552092; NPATLAS_NPA011550; CHEMSPIDER_8727483

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Chemical structure download