Gnidia B644130K212 origin
[8-(hexadecanoyloxymethyl)-6,7-dihydroxy-4,18-dimethyl-14-nonyl-5-oxo-16-prop-1-en-2-yl-9,13,15,19-tetraoxahexacyclo[12.4.1.01,11.02,6.08,10.012,16]nonadec-3-en-17-yl] benzoate
Also Known As: From Gnidia|Gnidilatin 20-palmitate|GNIDIA B644130K212 ORIGIN|4a-[(Hexadecanoyloxy)methyl]-5,5a-dihydroxy-7,9-dimethyl-2-nonyl-6-oxo-10a-(prop-1-en-2-yl)-3a,3c,4a,5,5a,6,8a,9,10,10a-decahydro-2H,3bH-2,8b-epoxyoxireno[6,7]azuleno[5,4-e][1,3]benzodioxol-10-yl benzoate
| Molecular Formula | C53H78O11 |
|---|---|
| Molecular Weight | 890.55444 g/mol |
| LogP | 13.1 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 29 |
| Exact Mass | 890.55444 |
| Monoisotopic Mass | 890.55444 |
| Heavy Atoms | 64 |
| Complexity | 1670.0 |
Chemical Identifiers
| CAS Number | 60195-67-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC12C(O1)C3C4C5(C(C(C3(C6C=C(C(=O)C6(C2O)O)C)OC(O4)(O5)CCCCCCCCC)C)OC(=O)C7=CC=CC=C7)C(=C)C |
| InChIKey | CQUDIRZDAJTGMG-UHFFFAOYSA-N |
Product Overview
Gnidia B644130K212 origin (CAS 60195-67-7), with molecular formula C53H78O11 and molecular weight 890.55444 g/mol. IUPAC: [8-(hexadecanoyloxymethyl)-6,7-dihydroxy-4,18-dimethyl-14-nonyl-5-oxo-16-prop-1-en-2-yl-9,13,15,19-tetraoxahexacyclo[12.4.1.01,11.02,6.08,10.012,16]nonadec-3-en-17-yl] benzoate.
Gnidia B644130K212 origin is a custom synthesis product. We offer services from milligram to kilogram scale.
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