(1R,2R,3S,6S,7S,9S,10S,11S,12R,13S,14R)-2,6,9,11,13,14-Hexahydroxy-11-Isopropyl-3,7,10-Trimethyl-15-Oxapentacyclo[7.5.1.0~1,6~.0~7,13~.0~10,14~]Pentadec-12-Yl 1H-Pyrrole-2-Carboxylate
Properties
Property | Value |
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Formula | C25H35NO9 |
IUPAC Name | (1r,2r,3s,6s,7s,9s,10s,11s,12r,13s,14r)-2,6,9,11,13,14-hexahydroxy-11-isopropyl-3,7,10-trimethyl-15-oxapentacyclo[7.5.1.0 1,6 .0 7,13 .0 10,14 ]pentadec-12-yl 1h-pyrrole-2-carboxylate |
Molecular Mass | 493.547 g·mol−1 |
Heat of Formation | -1648.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.73 ± 1.08 D |
Volume | 547.85 Å 3 |
Surface Area | 396.06 Å 2 |
HOMO Energy | -9.39 ± 0.55 eV |
LUMO Energy | -0.46 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | JJSYXNQGLHBRRK-YSOSZROBSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |