-Oryzanol

IUPAC: [(3R,6S,12S,15R,16R)-7,7,12,16-tetramethyl-15-(6-methylhept-5-en-2-yl)-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C40H58O4

-Oryzanol is a chemical compound with molecular formula C40H58O4 and molecular weight 602.9 g/mol .

What is -Oryzanol?

Molecular Formula
C40H58O4
Molecular Weight
602.90 g/mol

Structure Identifiers

SMILES
CC(CCC=C(C)C)[C@H]1CC[C@@]2([C@@]1(CCC34C2CCC5[C@]3(C4)CC[C@@H](C5(C)C)OC(=O)/C=C/C6=CC(=C(C=C6)O)OC)C)C
InChI
InChI=1S/C40H58O4/c1-26(2)10-9-11-27(3)29-18-20-38(7)33-16-15-32-36(4,5)34(19-21-39(32)25-40(33,39)23-22-37(29,38)6)44-35(42)17-13-28-12-14-30(41)31(24-28)43-8/h10,12-14,17,24,27,29,32-34,41H,9,11,15-16,18-23,25H2,1-8H3/b17-13+/t27?,29-,32?,33?,34+,37-,38+,39-,40?/m1/s1
InChIKey
FODTZLFLDFKIQH-XUNXSEOASA-N

Properties

Computed

Calculated molecular descriptors used in drug design and computational chemistry.

Exact Mass
602.4335 Da
XLogP
12.10
TPSA
55.8 Ų
H-Bond Donors
1
H-Bond Acceptors
4
Complexity
1,150
Formal Charge
0

Safety information

No safety data available for this chemical.

Synonyms (6)

  • PD087320
  • -Oryzanol
  • MFCD00867548
  • Gamma Oryzanol Powder
  • BRD-A69051038-001-01-2
  • [(3R,6S,12S,15R,16R)-7,7,12,16-tetramethyl-15-(6-methylhept-5-en-2-yl)-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

Frequently asked questions

What is the IUPAC name of -Oryzanol?

The IUPAC name of -Oryzanol is [(3R,6S,12S,15R,16R)-7,7,12,16-tetramethyl-15-(6-methylhept-5-en-2-yl)-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate.

What is the molecular formula of -Oryzanol?

-Oryzanol has the molecular formula C40H58O4 and a molecular weight of 602.9 g/mol.

What is the SMILES notation for -Oryzanol?

The SMILES notation for -Oryzanol is CC(CCC=C(C)C)[C@H]1CC[C@@]2([C@@]1(CCC34C2CCC5[C@]3(C4)CC[C@@H](C5(C)C)OC(=O)/C=C/C6=CC(=C(C=C6)O)OC)C)C.

What are other names for -Oryzanol?

-Oryzanol is also known as -Oryzanol, [(3R,6S,12S,15R,16R)-7,7,12,16-tetramethyl-15-(6-methylhept-5-en-2-yl)-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate, BRD-A69051038-001-01-2, Gamma Oryzanol Powder, MFCD00867548.

Data sourced from PubChem CID 51346127. Last updated .

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