Summary

Molecular formula: C37H58O5
SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)OCc1cc(OC)c(c(c1C=O)O)C/C=C(/CCC=C(C)C)C
InChI: InChI=1S/C37H58O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-36(39)42-29-32-27-35(41-5)33(37(40)34(32)28-38)26-25-31(4)23-21-22-30(2)3/h13-14,22,25,27-28,40H,6-12,15-21,23-24,26,29H2,1-5H3/b14-13+,31-25+
InChIKey: UJSYMVCGDZCLIO-DILIWIBYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccccc1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Prenol lipids
Sub class: Monoterpenoids

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Synonymous chemical names:
hericene b

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External chemical identifiers:
CID_131753059; CAS_157207-55-1; NPATLAS_NPA009171; CHEMSPIDER_28534151; ZINC_ZINC000085646231

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Chemical structure download