Summary

Molecular formula: C28H46O4
SMILES: O[C@H]1CC[C@]2([C@](C1)(O)[C@@H](O)[C@H]([C@@H]1[C@@H]2CC[C@]2(C1=CC[C@@H]2[C@@H](/C=C/[C@@H](C(C)C)C)C)C)O)C
InChI: InChI=1S/C28H46O4/c1-16(2)17(3)7-8-18(4)20-9-10-21-23-22(12-13-26(20,21)5)27(6)14-11-19(29)15-28(27,32)25(31)24(23)30/h7-8,10,16-20,22-25,29-32H,9,11-15H2,1-6H3/b8-7+/t17-,18+,19-,20+,22-,23-,24-,25-,26+,27+,28+/m0/s1
InChIKey: RAPOCBSGSDLPRY-NCQRGXQMSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=C2C(CC1)CCC1C2CCC2CCCCC21

Scaffold Graph/Node level:
C1CCC2C(C1)CCC1C3CCCC3CCC21

Scaffold Graph level:
C1CCC2C(C1)CCC1C3CCCC3CCC21

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Steroids and steroid derivatives
Sub class: Ergostane steroids

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Synonymous chemical names:
fomentarol b

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External chemical identifiers:
CID_102492168; NPATLAS_NPA012831; CHEMSPIDER_78443479

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Chemical structure download