14660-91-4
NEOXANTHIN
Name
NEOXANTHIN
Formula
C40 H58 O4
MolWeight
602.894
1Identification
【Name】
NEOXANTHIN
【CAS】
【MDL】
MFCD02752617
【English Synonyms】
【Formula】
C40 H58 O4
【MolWeight】
602.894
【Inchi】
InChI=1S/C40H58O4/c1-29(17-13-19-31(3)21-22-35-36(5,6)25-33(41)27-38(35,9)43)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-23,33-34,41-43H,24-28H2,1-10H3/b15-11+,16-12+,19-13+,20-14+,29-17+,30-18+,31-21+,32-23-,35-22+/t33-,34+,38-,39-,40+/m1/s1
【InChIKey】
InChIKey=UOFVIYXYKMPTKC-PMBUYOMDSA-N
【SMILES】
C/C(=C/C[C@]12C(C[C@@H](C[C@]1(O2)C)O)(C)C)/C=C/C=C(\C)/C=C/C=C/C(=C/C=C/C(=C/C=C/3\C(C[C@H](C[C@@]3(C)O)O)(C)C)/C)/C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:12.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
NEOXANTHIN.cml
Quick Release
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