Hexadecanoic acid, 2-hexyl-5-hydroxy-3-(phenylmethoxy)-, phenylmethyl ester, [2S-(2R*,3R*,5R*)]-
CAS Registry Number®
130793-32-7
CAS Name
Hexadecanoic acid, 2-hexyl-5-hydroxy-3-(phenylmethoxy)-, phenylmethyl ester, [2S-(2R*,3R*,5R*)]-Molecular Formula
C36H56O4Molecular Mass
552.83Cite this Page
Hexadecanoic acid, 2-hexyl-5-hydroxy-3-(phenylmethoxy)-, phenylmethyl ester, [2S-(2R*,3R*,5R*)]-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=130793-32-7 (retrieved ) (CAS RN: 130793-32-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C36H56O4/c1-3-5-7-9-10-11-12-13-20-26-33(37)28-35(39-29-31-22-16-14-17-23-31)34(27-21-8-6-4-2)36(38)40-30-32-24-18-15-19-25-32/h14-19,22-25,33-35,37H,3-13,20-21,26-30H2,1-2H3/t33-,34-,35-/m0/s1
InChIKey
InChIKey=DQNHJPYWBHTPOH-IMKBVMFZSA-N
SMILES
[C@H]([C@@H](OCC1=CC=CC=C1)C[C@H](CCCCCCCCCCC)O)(C(OCC2=CC=CC=C2)=O)CCCCCC
Canonical SMILES
O=C(OCC=1C=CC=CC1)C(CCCCCC)C(OCC=2C=CC=CC2)CC(O)CCCCCCCCCCC
Other Names for this Substance
- Hexadecanoic acid, 2-hexyl-5-hydroxy-3-(phenylmethoxy)-, phenylmethyl ester, [2S-(2R*,3R*,5R*)]-
